Fluorobenzenes

Organic compounds considered aryl halides that consist of a phenyl group with a fluorine atom substitution in the following structure: C₆H₅F.

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Fluconazole, 99%

CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.277 MDL Number: MFCD00274549 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

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Specifications

PubChem CID	3365
CAS	86386-73-4
Molecular Weight (g/mol)	306.277
ChEBI	CHEBI:46081
MDL Number	MFCD00274549
SMILES	C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym	fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name	2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key	RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula	C13H12F2N6O

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O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride, 99+%

CAS: 57981-02-9 Molecular Formula: C7H5ClF5NO Molecular Weight (g/mol): 249.57 MDL Number: MFCD00012953 InChI Key: HVMVKNXIMUCYJA-UHFFFAOYSA-N Synonym: o-2,3,4,5,6-pentafluorobenzyl hydroxylamine hydrochloride,florox reagent,o-perfluorophenyl methyl hydroxylamine hydrochloride,hydroxylamine, o-pentafluorophenyl methyl-, hydrochloride,o-pentafluorobenzyl hydroxylamine hydrochloride,o-2,3,4,5,6-pentafluorophenyl methyl hydroxylamine hydrochloride,oxy 2,3,4,5,6-pentafluorophenyl methyl amine, chloride,pfbha.hcl,acmc-1b0zv PubChem CID: 122307 IUPAC Name: O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride SMILES: [H+].[Cl-].NOCC1=C(F)C(F)=C(F)C(F)=C1F

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PubChem CID	122307
CAS	57981-02-9
Molecular Weight (g/mol)	249.57
MDL Number	MFCD00012953
SMILES	[H+].[Cl-].NOCC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	o-2,3,4,5,6-pentafluorobenzyl hydroxylamine hydrochloride,florox reagent,o-perfluorophenyl methyl hydroxylamine hydrochloride,hydroxylamine, o-pentafluorophenyl methyl-, hydrochloride,o-pentafluorobenzyl hydroxylamine hydrochloride,o-2,3,4,5,6-pentafluorophenyl methyl hydroxylamine hydrochloride,oxy 2,3,4,5,6-pentafluorophenyl methyl amine, chloride,pfbha.hcl,acmc-1b0zv
IUPAC Name	O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride
InChI Key	HVMVKNXIMUCYJA-UHFFFAOYSA-N
Molecular Formula	C7H5ClF5NO

1,2-Difluorobenzene, 98+%

CAS: 367-11-3 Molecular Formula: C6H4F2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00000284 InChI Key: GOYDNIKZWGIXJT-UHFFFAOYSA-N Synonym: o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene PubChem CID: 9706 ChEBI: CHEBI:38583 IUPAC Name: 1,2-difluorobenzene SMILES: FC1=CC=CC=C1F

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Specifications

PubChem CID	9706
CAS	367-11-3
Molecular Weight (g/mol)	114.10
ChEBI	CHEBI:38583
MDL Number	MFCD00000284
SMILES	FC1=CC=CC=C1F
Synonym	o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene
IUPAC Name	1,2-difluorobenzene
InChI Key	GOYDNIKZWGIXJT-UHFFFAOYSA-N
Molecular Formula	C6H4F2

Thermo Scientific Chemicals Fluconazole, 98%

CAS: 86386-73-4 Molecular Formula: C₁₃H₁₂F₂N₆O Molecular Weight (g/mol): 306.27 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

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Specifications

PubChem CID	3365
CAS	86386-73-4
Molecular Weight (g/mol)	306.27
ChEBI	CHEBI:46081
SMILES	C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym	fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name	2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key	RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₂F₂N₆O

Bromopentafluorobenzene, 99%

CAS: 344-04-7 Molecular Formula: C6BrF5 Molecular Weight (g/mol): 246.96 MDL Number: MFCD00000287 InChI Key: XEKTVXADUPBFOA-UHFFFAOYSA-N Synonym: bromopentafluorobenzene,pentafluorobromobenzene,benzene, bromopentafluoro,bromoperfluorobenzene,pentafluorophenyl bromide,2,3,4,5,6-pentafluorobromobenzene,benzene, 1-bromo-2,3,4,5,6-pentafluoro,1-bromo-pentafluorobenzene,2,3,4,5,6-bromopentafluorobenzene,1-bromo-2,3,4,5,6-pentafluoro-benzene PubChem CID: 9578 IUPAC Name: 1-bromo-2,3,4,5,6-pentafluorobenzene SMILES: FC1=C(F)C(F)=C(Br)C(F)=C1F

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Specifications

PubChem CID	9578
CAS	344-04-7
Molecular Weight (g/mol)	246.96
MDL Number	MFCD00000287
SMILES	FC1=C(F)C(F)=C(Br)C(F)=C1F
Synonym	bromopentafluorobenzene,pentafluorobromobenzene,benzene, bromopentafluoro,bromoperfluorobenzene,pentafluorophenyl bromide,2,3,4,5,6-pentafluorobromobenzene,benzene, 1-bromo-2,3,4,5,6-pentafluoro,1-bromo-pentafluorobenzene,2,3,4,5,6-bromopentafluorobenzene,1-bromo-2,3,4,5,6-pentafluoro-benzene
IUPAC Name	1-bromo-2,3,4,5,6-pentafluorobenzene
InChI Key	XEKTVXADUPBFOA-UHFFFAOYSA-N
Molecular Formula	C6BrF5

PubChem CID	9706
CAS	367-11-3
Molecular Weight (g/mol)	114.10
ChEBI	CHEBI:38583
MDL Number	MFCD00000284
SMILES	FC1=CC=CC=C1F
Synonym	o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene
IUPAC Name	1,2-difluorobenzene
InChI Key	GOYDNIKZWGIXJT-UHFFFAOYSA-N
Molecular Formula	C6H4F2

4-Fluoro-1,2-dimethoxybenzene, 98%

CAS: 398-62-9 Molecular Formula: C8H9FO2 Molecular Weight (g/mol): 156.156 MDL Number: MFCD00012201 InChI Key: DAGKHJDZYJFWSO-UHFFFAOYSA-N Synonym: 4-fluoroveratrole,1,2-dimethoxy-4-fluorobenzene,3,4-dimethoxyfluorobenzene,1-fluoro-3,4-dimethoxybenzene,4-fluoro-1,2-dimethoxy-benzene,3,4-dimethoxy-1-fluorobenzene,4-fluoroveratrol,pubchem3048,acmc-1acnf,fluorobenzene, 3,4-methoxy PubChem CID: 593640 IUPAC Name: 4-fluoro-1,2-dimethoxybenzene SMILES: COC1=C(C=C(C=C1)F)OC

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PubChem CID	593640
CAS	398-62-9
Molecular Weight (g/mol)	156.156
MDL Number	MFCD00012201
SMILES	COC1=C(C=C(C=C1)F)OC
Synonym	4-fluoroveratrole,1,2-dimethoxy-4-fluorobenzene,3,4-dimethoxyfluorobenzene,1-fluoro-3,4-dimethoxybenzene,4-fluoro-1,2-dimethoxy-benzene,3,4-dimethoxy-1-fluorobenzene,4-fluoroveratrol,pubchem3048,acmc-1acnf,fluorobenzene, 3,4-methoxy
IUPAC Name	4-fluoro-1,2-dimethoxybenzene
InChI Key	DAGKHJDZYJFWSO-UHFFFAOYSA-N
Molecular Formula	C8H9FO2

2-Fluoromesitylene, 98%

CAS: 392-69-8 Molecular Formula: C9H11F Molecular Weight (g/mol): 138.19 MDL Number: MFCD00052365 InChI Key: ZLGPNBBJPOBSLY-UHFFFAOYSA-N Synonym: fluoromesitylene,mesityl fluoride,2-fluoromesitylene,2,4,6-trimethylfluorobenzene,benzene, 2-fluoro-1,3,5-trimethyl,1-fluoro-2,4,6-trimethylbenzene,2-fluoro-1,3,5-trimethyl-benzene,fluormesitylen,mesitylfluoride,pubchem16939 PubChem CID: 136234 IUPAC Name: 2-fluoro-1,3,5-trimethylbenzene SMILES: CC1=CC(C)=C(F)C(C)=C1

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Specifications

PubChem CID	136234
CAS	392-69-8
Molecular Weight (g/mol)	138.19
MDL Number	MFCD00052365
SMILES	CC1=CC(C)=C(F)C(C)=C1
Synonym	fluoromesitylene,mesityl fluoride,2-fluoromesitylene,2,4,6-trimethylfluorobenzene,benzene, 2-fluoro-1,3,5-trimethyl,1-fluoro-2,4,6-trimethylbenzene,2-fluoro-1,3,5-trimethyl-benzene,fluormesitylen,mesitylfluoride,pubchem16939
IUPAC Name	2-fluoro-1,3,5-trimethylbenzene
InChI Key	ZLGPNBBJPOBSLY-UHFFFAOYSA-N
Molecular Formula	C9H11F

3-Fluoroaniline, 98+%

CAS: 372-19-0 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.119 MDL Number: MFCD00007758 InChI Key: QZVQQUVWFIZUBQ-UHFFFAOYSA-N Synonym: m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech PubChem CID: 9742 ChEBI: CHEBI:27873 IUPAC Name: 3-fluoroaniline SMILES: C1=CC(=CC(=C1)F)N

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Specifications

PubChem CID	9742
CAS	372-19-0
Molecular Weight (g/mol)	111.119
ChEBI	CHEBI:27873
MDL Number	MFCD00007758
SMILES	C1=CC(=CC(=C1)F)N
Synonym	m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech
IUPAC Name	3-fluoroaniline
InChI Key	QZVQQUVWFIZUBQ-UHFFFAOYSA-N
Molecular Formula	C6H6FN

4-Fluoroaniline, 99%

CAS: 371-40-4 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007829 InChI Key: KRZCOLNOCZKSDF-UHFFFAOYSA-N Synonym: p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline PubChem CID: 9731 ChEBI: CHEBI:28546 IUPAC Name: 4-fluoroaniline SMILES: NC1=CC=C(F)C=C1

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Specifications

PubChem CID	9731
CAS	371-40-4
Molecular Weight (g/mol)	111.12
ChEBI	CHEBI:28546
MDL Number	MFCD00007829
SMILES	NC1=CC=C(F)C=C1
Synonym	p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline
IUPAC Name	4-fluoroaniline
InChI Key	KRZCOLNOCZKSDF-UHFFFAOYSA-N
Molecular Formula	C6H6FN

2,3,4,5,6-Pentafluoroaniline, 97%

CAS: 771-60-8 Molecular Formula: C6H2F5N Molecular Weight (g/mol): 183.08 MDL Number: MFCD00007643 InChI Key: NOXLGCOSAFGMDV-UHFFFAOYSA-N Synonym: pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546 PubChem CID: 13040 IUPAC Name: 2,3,4,5,6-pentafluoroaniline SMILES: NC1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	13040
CAS	771-60-8
Molecular Weight (g/mol)	183.08
MDL Number	MFCD00007643
SMILES	NC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546
IUPAC Name	2,3,4,5,6-pentafluoroaniline
InChI Key	NOXLGCOSAFGMDV-UHFFFAOYSA-N
Molecular Formula	C6H2F5N

Fluorobenzene, 99%

CAS: 462-06-6 Molecular Formula: C6H5F Molecular Weight (g/mol): 96.10 MDL Number: MFCD00000280 InChI Key: PYLWMHQQBFSUBP-UHFFFAOYSA-N Synonym: benzene, fluoro,monofluorobenzene,phenyl fluoride,fluorbenzol,fluoro-benzene,4-fluorobenzene,unii-g3tsz68k12,fluoranylbenzene,fluorobenzenes,1,2,3,4,5-pentadeuterio-6-fluorobenzene PubChem CID: 10008 ChEBI: CHEBI:5115 IUPAC Name: fluorobenzene SMILES: FC1=CC=CC=C1

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Specifications

PubChem CID	10008
CAS	462-06-6
Molecular Weight (g/mol)	96.10
ChEBI	CHEBI:5115
MDL Number	MFCD00000280
SMILES	FC1=CC=CC=C1
Synonym	benzene, fluoro,monofluorobenzene,phenyl fluoride,fluorbenzol,fluoro-benzene,4-fluorobenzene,unii-g3tsz68k12,fluoranylbenzene,fluorobenzenes,1,2,3,4,5-pentadeuterio-6-fluorobenzene
IUPAC Name	fluorobenzene
InChI Key	PYLWMHQQBFSUBP-UHFFFAOYSA-N
Molecular Formula	C6H5F

Pentafluoroaniline, 97%

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Specifications

PubChem CID	13040
CAS	771-60-8
Molecular Weight (g/mol)	183.08
MDL Number	MFCD00007643
SMILES	NC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546
InChI Key	NOXLGCOSAFGMDV-UHFFFAOYSA-N
Molecular Formula	C6H2F5N

2,3,5,6-Tetrafluoro-7,7,8,8-tetracyanoquinodimethane, 95%

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Sodium tetrakis(4-fluorophenyl)borate dihydrate, 98%

CAS: 207683-22-5 Molecular Formula: C24H20BF4NaO2 Molecular Weight (g/mol): 450.215 MDL Number: MFCD00149598 InChI Key: MSDGDEJOIBMWJD-UHFFFAOYSA-N Synonym: sodium tetrakis 4-fluorophenyl borate dihydrate,cesibor,tetrakis 4-fluorophenyl boron sodium,sodium tetrakis 4-fluorophenyl boranuide dihydrate,sodium tetrakis 4-fluorophenyl borate dihydrate nt,sodium tetrakis 4-fluorophenyl borate dihydrate, selectophore tm PubChem CID: 45073643 IUPAC Name: sodium;tetrakis(4-fluorophenyl)boranuide;dihydrate SMILES: [B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.O.O.[Na+]

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Specifications

PubChem CID	45073643
CAS	207683-22-5
Molecular Weight (g/mol)	450.215
MDL Number	MFCD00149598
SMILES	[B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.O.O.[Na+]
Synonym	sodium tetrakis 4-fluorophenyl borate dihydrate,cesibor,tetrakis 4-fluorophenyl boron sodium,sodium tetrakis 4-fluorophenyl boranuide dihydrate,sodium tetrakis 4-fluorophenyl borate dihydrate nt,sodium tetrakis 4-fluorophenyl borate dihydrate, selectophore tm
IUPAC Name	sodium;tetrakis(4-fluorophenyl)boranuide;dihydrate
InChI Key	MSDGDEJOIBMWJD-UHFFFAOYSA-N
Molecular Formula	C24H20BF4NaO2

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