Aniline and substituted anilines

Organic compounds that consist of a phenyl group attached to an amino group; aniline is the simplest aromatic amine. Anilines with additional substitutions are included.

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1 – 15 of 187 results

p-Anisidine, 99%

CAS: 104-94-9 Molecular Formula: C₇H₉NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00007864 InChI Key: BHAAPTBBJKJZER-UHFFFAOYSA-N Synonym: p-anisidine,4-anisidine,4-methoxybenzenamine,4-aminoanisole,p-aminoanisole,para-anisidine,p-methoxyaniline,benzenamine, 4-methoxy,4-methoxybenzeneamine,p-anisylamine PubChem CID: 7732 ChEBI: CHEBI:82388 IUPAC Name: 4-methoxyaniline SMILES: COC1=CC=C(C=C1)N

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Specifications

PubChem CID	7732
CAS	104-94-9
Molecular Weight (g/mol)	123.15
ChEBI	CHEBI:82388
MDL Number	MFCD00007864
SMILES	COC1=CC=C(C=C1)N
Synonym	p-anisidine,4-anisidine,4-methoxybenzenamine,4-aminoanisole,p-aminoanisole,para-anisidine,p-methoxyaniline,benzenamine, 4-methoxy,4-methoxybenzeneamine,p-anisylamine
IUPAC Name	4-methoxyaniline
InChI Key	BHAAPTBBJKJZER-UHFFFAOYSA-N
Molecular Formula	C₇H₉NO

3,5-Dinitroaniline, 98%

CAS: 618-87-1 MDL Number: MFCD00007263 InChI Key: MPBZUKLDHPOCLS-UHFFFAOYSA-N Synonym: benzenamine, 3,5-dinitro,aniline, 3,5-dinitro,unii-0ahr6k1n73,ccris 3109,3,5-dinitrophenylamine,3-5-dinitro-phenylamine,3,5-dinitroanilin,aniline,5-dinitro,acmc-209mx8,benzenamine,3,5-dinitro PubChem CID: 12068 IUPAC Name: 3,5-dinitroaniline SMILES: C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N

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Specifications

PubChem CID	12068
CAS	618-87-1
MDL Number	MFCD00007263
SMILES	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N
Synonym	benzenamine, 3,5-dinitro,aniline, 3,5-dinitro,unii-0ahr6k1n73,ccris 3109,3,5-dinitrophenylamine,3-5-dinitro-phenylamine,3,5-dinitroanilin,aniline,5-dinitro,acmc-209mx8,benzenamine,3,5-dinitro
IUPAC Name	3,5-dinitroaniline
InChI Key	MPBZUKLDHPOCLS-UHFFFAOYSA-N

4-Methoxybenzenediazonium tetrafluoroborate, 98%

CAS: 459-64-3 Molecular Formula: C7H7BF4N2O Molecular Weight (g/mol): 221.95 MDL Number: MFCD00011897 InChI Key: CACFTKIREZJSIG-UHFFFAOYSA-J Synonym: 4-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzenediazoniumfluoroborate,4-methoxybenzene diazonium fluoroborate,acmc-1aeuk,ksc236e8f,4-methoxyphenyldiazonium tetrafluoroborate,p-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzene-1-diazonium; tetrafluoroboranuide PubChem CID: 517233 SMILES: [B+3].[F-].[F-].[F-].[F-].COC1=CC=C(C=C1)[N+]#N

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Specifications

PubChem CID	517233
CAS	459-64-3
Molecular Weight (g/mol)	221.95
MDL Number	MFCD00011897
SMILES	[B+3].[F-].[F-].[F-].[F-].COC1=CC=C(C=C1)[N+]#N
Synonym	4-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzenediazoniumfluoroborate,4-methoxybenzene diazonium fluoroborate,acmc-1aeuk,ksc236e8f,4-methoxyphenyldiazonium tetrafluoroborate,p-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzene-1-diazonium; tetrafluoroboranuide
InChI Key	CACFTKIREZJSIG-UHFFFAOYSA-J
Molecular Formula	C7H7BF4N2O

3,4,5-Trimethoxyaniline, 98+%

CAS: 24313-88-0 Molecular Formula: C9H13NO3 Molecular Weight (g/mol): 183.207 MDL Number: MFCD00008393 InChI Key: XEFRNCLPPFDWAC-UHFFFAOYSA-N Synonym: benzenamine, 3,4,5-trimethoxy,3,4,5-trimethoxy aniline,3,4,5-trimethoxybenzenamine,3,4,5-trimethoxy-phenylamine,3,4,5-trimethoxyphenylamine,3,5-trimethoxyaniline,3,4,5-trimethoxyanilin,acmc-1cdy7,intermediates-zcf02654,3,4,5-trimethoxyaniline PubChem CID: 32285 IUPAC Name: 3,4,5-trimethoxyaniline SMILES: COC1=CC(=CC(=C1OC)OC)N

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Specifications

PubChem CID	32285
CAS	24313-88-0
Molecular Weight (g/mol)	183.207
MDL Number	MFCD00008393
SMILES	COC1=CC(=CC(=C1OC)OC)N
Synonym	benzenamine, 3,4,5-trimethoxy,3,4,5-trimethoxy aniline,3,4,5-trimethoxybenzenamine,3,4,5-trimethoxy-phenylamine,3,4,5-trimethoxyphenylamine,3,5-trimethoxyaniline,3,4,5-trimethoxyanilin,acmc-1cdy7,intermediates-zcf02654,3,4,5-trimethoxyaniline
IUPAC Name	3,4,5-trimethoxyaniline
InChI Key	XEFRNCLPPFDWAC-UHFFFAOYSA-N
Molecular Formula	C9H13NO3

3,5-Dibromo-o-phenylenediamine monohydrochloride, 99%, Thermo Scientific™

CAS: 75568-11-5 Molecular Formula: C₆H₆Br₂N₂·HCl Molecular Weight (g/mol): 302.4 MDL Number: MFCD00012967 InChI Key: QOZDVKFQMGARCC-UHFFFAOYSA-N Synonym: 3,5-dibromo-1,2-phenylenediamine monohydrochloride,3,5-dibromobenzene-1,2-diamine hydrochloride,acmc-20andn,1,2-diamino-3,5-dibromobenzene monohydrochloride,3,5-bis bromanyl benzene-1,2-diamine hydrochloride,3,5-dibromo-1,2-phenylenediamine hydrochloride,1,2-benzenediamine,3,5-dibromo-, hydrochloride 1:1,3,5-dibromo-ortho-phenylenediamine monohydrochloride,3,5-dibromobenzene-1,2-diamine-hydrogen chloride 1/1,3,5-dibromo-1,2-phenylenediaminemonohydrochloride sensitivereagentforthedeterminationofsebygc-ecd PubChem CID: 2724285 IUPAC Name: 3,5-dibromobenzene-1,2-diamine;hydrochloride SMILES: C1=C(C=C(C(=C1Br)N)N)Br.Cl

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Specifications

PubChem CID	2724285
CAS	75568-11-5
Molecular Weight (g/mol)	302.4
MDL Number	MFCD00012967
SMILES	C1=C(C=C(C(=C1Br)N)N)Br.Cl
Synonym	3,5-dibromo-1,2-phenylenediamine monohydrochloride,3,5-dibromobenzene-1,2-diamine hydrochloride,acmc-20andn,1,2-diamino-3,5-dibromobenzene monohydrochloride,3,5-bis bromanyl benzene-1,2-diamine hydrochloride,3,5-dibromo-1,2-phenylenediamine hydrochloride,1,2-benzenediamine,3,5-dibromo-, hydrochloride 1:1,3,5-dibromo-ortho-phenylenediamine monohydrochloride,3,5-dibromobenzene-1,2-diamine-hydrogen chloride 1/1,3,5-dibromo-1,2-phenylenediaminemonohydrochloride sensitivereagentforthedeterminationofsebygc-ecd
IUPAC Name	3,5-dibromobenzene-1,2-diamine;hydrochloride
InChI Key	QOZDVKFQMGARCC-UHFFFAOYSA-N
Molecular Formula	C₆H₆Br₂N₂·HCl

3,4-Diaminoanisole dihydrochloride, 98%

CAS: 59548-39-9 Molecular Formula: C₇H₁₀N₂O·₂ClH Molecular Weight (g/mol): 211.09 InChI Key: SXCHMHOBHJOXGC-UHFFFAOYSA-N Synonym: 4-methoxybenzene-1,2-diamine dihydrochloride,4-methoxy-o-phenylenediamine dihydrochloride,3,4-diaminoanisole dihydrochloride,1,2-benzenediamine, 4-methoxy-, dihydrochloride,3,4-diaminoanisole 2hcl,4-methoxy-phenylenediamine dihydrochloride,4-methoxy-1,2-benzenediamine dihydrochloride,4-methoxy-benzene-1,2-diamine dihydrochloride,4-methoxy-1,2-phenylenediamine dihydrochloride,4-methoxy-l,2-phenylene diamine dihydrochloride PubChem CID: 3085161 IUPAC Name: 4-methoxybenzene-1,2-diamine;dihydrochloride SMILES: COC1=CC(=C(C=C1)N)N.Cl.Cl

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Specifications

PubChem CID	3085161
CAS	59548-39-9
Molecular Weight (g/mol)	211.09
SMILES	COC1=CC(=C(C=C1)N)N.Cl.Cl
Synonym	4-methoxybenzene-1,2-diamine dihydrochloride,4-methoxy-o-phenylenediamine dihydrochloride,3,4-diaminoanisole dihydrochloride,1,2-benzenediamine, 4-methoxy-, dihydrochloride,3,4-diaminoanisole 2hcl,4-methoxy-phenylenediamine dihydrochloride,4-methoxy-1,2-benzenediamine dihydrochloride,4-methoxy-benzene-1,2-diamine dihydrochloride,4-methoxy-1,2-phenylenediamine dihydrochloride,4-methoxy-l,2-phenylene diamine dihydrochloride
IUPAC Name	4-methoxybenzene-1,2-diamine;dihydrochloride
InChI Key	SXCHMHOBHJOXGC-UHFFFAOYSA-N
Molecular Formula	C₇H₁₀N₂O·₂ClH

4-Bromo-3-methoxyaniline, 97%

CAS: 19056-40-7 Molecular Formula: C7H8BrNO Molecular Weight (g/mol): 202.05 MDL Number: MFCD05664063 InChI Key: RUTNWXBHRAIQSP-UHFFFAOYSA-N Synonym: 5-amino-2-bromoanisole,4-bromo-m-anisidine,4-bromo-3-methoxy-phenylamine,4-bromo-3-methoxy-aniline,3-methoxy-4-bromoaniline,4-bromo-3-methoxy aniline,4-bromo-3-methoxyphenylamine,benzenamine, 4-bromo-3-methoxy,4-bromo-3-methoxybenzenamine,pubchem3794 PubChem CID: 7018254 IUPAC Name: 4-bromo-3-methoxyaniline SMILES: COC1=C(Br)C=CC(N)=C1

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Specifications

PubChem CID	7018254
CAS	19056-40-7
Molecular Weight (g/mol)	202.05
MDL Number	MFCD05664063
SMILES	COC1=C(Br)C=CC(N)=C1
Synonym	5-amino-2-bromoanisole,4-bromo-m-anisidine,4-bromo-3-methoxy-phenylamine,4-bromo-3-methoxy-aniline,3-methoxy-4-bromoaniline,4-bromo-3-methoxy aniline,4-bromo-3-methoxyphenylamine,benzenamine, 4-bromo-3-methoxy,4-bromo-3-methoxybenzenamine,pubchem3794
IUPAC Name	4-bromo-3-methoxyaniline
InChI Key	RUTNWXBHRAIQSP-UHFFFAOYSA-N
Molecular Formula	C7H8BrNO

2-Amino-3-bromobenzonitrile, 95%

CAS: 114344-60-4 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.035 InChI Key: RTIWACSVMFUEBF-UHFFFAOYSA-N Synonym: 2-bromo-6-cyanoaniline,benzonitrile, 2-amino-3-bromo,3-bromoanthranilonitrile,2-amino-3-bromo-benzonitrile,2-amino-3-bromobenzonitrile; 3-bromoanthranilonitrile PubChem CID: 4564338 IUPAC Name: 2-amino-3-bromobenzonitrile SMILES: C1=CC(=C(C(=C1)Br)N)C#N

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Specifications

PubChem CID	4564338
CAS	114344-60-4
Molecular Weight (g/mol)	197.035
SMILES	C1=CC(=C(C(=C1)Br)N)C#N
Synonym	2-bromo-6-cyanoaniline,benzonitrile, 2-amino-3-bromo,3-bromoanthranilonitrile,2-amino-3-bromo-benzonitrile,2-amino-3-bromobenzonitrile; 3-bromoanthranilonitrile
IUPAC Name	2-amino-3-bromobenzonitrile
InChI Key	RTIWACSVMFUEBF-UHFFFAOYSA-N
Molecular Formula	C7H5BrN2

5-Chloro-2-methoxyaniline, 98%

CAS: 95-03-4 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00007777 InChI Key: WBSMIPLNPSCJFS-UHFFFAOYSA-N Synonym: 2-amino-4-chloroanisole,5-chloro-o-anisidine,benzenamine, 5-chloro-2-methoxy,2-methoxy-5-chloroaniline,tulabase fast red r,tulabase fast red rc,4-chloro-2-aminoanisole,o-anisidine, 5-chloro,5-chloro-2-methoxyphenylamine,p-chloro-o-aminoanisole PubChem CID: 66763 IUPAC Name: 5-chloro-2-methoxyaniline SMILES: COC1=C(C=C(C=C1)Cl)N

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Specifications

PubChem CID	66763
CAS	95-03-4
Molecular Weight (g/mol)	157.597
MDL Number	MFCD00007777
SMILES	COC1=C(C=C(C=C1)Cl)N
Synonym	2-amino-4-chloroanisole,5-chloro-o-anisidine,benzenamine, 5-chloro-2-methoxy,2-methoxy-5-chloroaniline,tulabase fast red r,tulabase fast red rc,4-chloro-2-aminoanisole,o-anisidine, 5-chloro,5-chloro-2-methoxyphenylamine,p-chloro-o-aminoanisole
IUPAC Name	5-chloro-2-methoxyaniline
InChI Key	WBSMIPLNPSCJFS-UHFFFAOYSA-N
Molecular Formula	C7H8ClNO

4-Methoxy-o-phenylenediamine dihydrochloride, 96%

CAS: 59548-39-9 Molecular Formula: C7H12Cl2N2O Molecular Weight (g/mol): 211.086 MDL Number: MFCD00052003 InChI Key: SXCHMHOBHJOXGC-UHFFFAOYSA-N Synonym: 4-methoxybenzene-1,2-diamine dihydrochloride,4-methoxy-o-phenylenediamine dihydrochloride,3,4-diaminoanisole dihydrochloride,1,2-benzenediamine, 4-methoxy-, dihydrochloride,3,4-diaminoanisole 2hcl,4-methoxy-phenylenediamine dihydrochloride,4-methoxy-1,2-benzenediamine dihydrochloride,4-methoxy-benzene-1,2-diamine dihydrochloride,4-methoxy-1,2-phenylenediamine dihydrochloride,4-methoxy-l,2-phenylene diamine dihydrochloride PubChem CID: 3085161 IUPAC Name: 4-methoxybenzene-1,2-diamine;dihydrochloride SMILES: COC1=CC(=C(C=C1)N)N.Cl.Cl

Pricing and Availability
Specifications

PubChem CID	3085161
CAS	59548-39-9
Molecular Weight (g/mol)	211.086
MDL Number	MFCD00052003
SMILES	COC1=CC(=C(C=C1)N)N.Cl.Cl
Synonym	4-methoxybenzene-1,2-diamine dihydrochloride,4-methoxy-o-phenylenediamine dihydrochloride,3,4-diaminoanisole dihydrochloride,1,2-benzenediamine, 4-methoxy-, dihydrochloride,3,4-diaminoanisole 2hcl,4-methoxy-phenylenediamine dihydrochloride,4-methoxy-1,2-benzenediamine dihydrochloride,4-methoxy-benzene-1,2-diamine dihydrochloride,4-methoxy-1,2-phenylenediamine dihydrochloride,4-methoxy-l,2-phenylene diamine dihydrochloride
IUPAC Name	4-methoxybenzene-1,2-diamine;dihydrochloride
InChI Key	SXCHMHOBHJOXGC-UHFFFAOYSA-N
Molecular Formula	C7H12Cl2N2O

2-Methoxyphenyl isocyanate, 98%

CAS: 700-87-8 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00002004 InChI Key: SUVCZZADQDCIEQ-UHFFFAOYSA-N Synonym: 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate PubChem CID: 69695 IUPAC Name: 1-isocyanato-2-methoxybenzene SMILES: COC1=CC=CC=C1N=C=O

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Specifications

PubChem CID	69695
CAS	700-87-8
Molecular Weight (g/mol)	149.15
MDL Number	MFCD00002004
SMILES	COC1=CC=CC=C1N=C=O
Synonym	2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate
IUPAC Name	1-isocyanato-2-methoxybenzene
InChI Key	SUVCZZADQDCIEQ-UHFFFAOYSA-N
Molecular Formula	C8H7NO2

3,3'-Dimethoxybenzidine, 97%

CAS: 119-90-4 Molecular Formula: C₁₄H₁₆N₂O₂ Molecular Weight (g/mol): 244.29 MDL Number: MFCD00008372 InChI Key: JRBJSXQPQWSCCF-UHFFFAOYSA-N Synonym: 3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b PubChem CID: 8411 ChEBI: CHEBI:82321 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N

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Specifications

PubChem CID	8411
CAS	119-90-4
Molecular Weight (g/mol)	244.29
ChEBI	CHEBI:82321
MDL Number	MFCD00008372
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N
Synonym	3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b
IUPAC Name	4-(4-amino-3-methoxyphenyl)-2-methoxyaniline
InChI Key	JRBJSXQPQWSCCF-UHFFFAOYSA-N
Molecular Formula	C₁₄H₁₆N₂O₂

3-Methoxyphenylisothiocyanate, ≥97%, Thermo Scientific™

CAS: 3125-64-2 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00040335 InChI Key: WHBYCPUKGYEYFU-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,# PubChem CID: 137832 IUPAC Name: 1-isothiocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=S

Pricing and Availability
Specifications

PubChem CID	137832
CAS	3125-64-2
Molecular Weight (g/mol)	165.21
MDL Number	MFCD00040335
SMILES	COC1=CC=CC(=C1)N=C=S
Synonym	3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,#
IUPAC Name	1-isothiocyanato-3-methoxybenzene
InChI Key	WHBYCPUKGYEYFU-UHFFFAOYSA-N
Molecular Formula	C8H7NOS

4-Bromo-5-fluoro-2-methoxyaniline, 96%, Thermo Scientific Chemicals

CAS: 330794-03-1 Molecular Formula: C7H7BrFNO Molecular Weight (g/mol): 220.04 MDL Number: MFCD21603958 InChI Key: WOFOKKKWMDHLEX-UHFFFAOYSA-N Synonym: benzenamine, 4-bromo-5-fluoro-2-methoxy PubChem CID: 22347298 IUPAC Name: 4-bromo-5-fluoro-2-methoxyaniline SMILES: COC1=CC(Br)=C(F)C=C1N

Pricing and Availability
Specifications

PubChem CID	22347298
CAS	330794-03-1
Molecular Weight (g/mol)	220.04
MDL Number	MFCD21603958
SMILES	COC1=CC(Br)=C(F)C=C1N
Synonym	benzenamine, 4-bromo-5-fluoro-2-methoxy
IUPAC Name	4-bromo-5-fluoro-2-methoxyaniline
InChI Key	WOFOKKKWMDHLEX-UHFFFAOYSA-N
Molecular Formula	C7H7BrFNO

2,6-Dibromoaniline, 97%

CAS: 608-30-0 Molecular Formula: C6H5Br2N Molecular Weight (g/mol): 250.92 MDL Number: MFCD00007638 InChI Key: XIRRDAWDNHRRLB-UHFFFAOYSA-N Synonym: benzenamine, 2,6-dibromo,2,6-dibromophenylamine,2,6-dibromobenzenamine,aniline, 2,6-dibromo,2,6-dibromo-phenylamine,2,6-dibromo-aniline,acmc-1aycf,2,6-dibromoaniline,2,6-dibromo-phenyl-amine,ksc356c3l PubChem CID: 69098 IUPAC Name: 2,6-dibromoaniline SMILES: NC1=C(Br)C=CC=C1Br

Pricing and Availability
Specifications

PubChem CID	69098
CAS	608-30-0
Molecular Weight (g/mol)	250.92
MDL Number	MFCD00007638
SMILES	NC1=C(Br)C=CC=C1Br
Synonym	benzenamine, 2,6-dibromo,2,6-dibromophenylamine,2,6-dibromobenzenamine,aniline, 2,6-dibromo,2,6-dibromo-phenylamine,2,6-dibromo-aniline,acmc-1aycf,2,6-dibromoaniline,2,6-dibromo-phenyl-amine,ksc356c3l
IUPAC Name	2,6-dibromoaniline
InChI Key	XIRRDAWDNHRRLB-UHFFFAOYSA-N
Molecular Formula	C6H5Br2N

Aniline and substituted anilines

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