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Phenoxy compounds

Organic compounds that have one or more phenyl groups that are bonded to an oxygen with a radical electron; includes compounds with additional substitutions.

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1

2-Phenoxyethanol, 94%

CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

EDGE
PubChem CID 31236
CAS 122-99-6
Molecular Weight (g/mol) 138.166
ChEBI CHEBI:64275
MDL Number MFCD00002857
SMILES C1=CC=C(C=C1)OCCO
Synonym phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
IUPAC Name 2-phenoxyethanol
InChI Key QCDWFXQBSFUVSP-UHFFFAOYSA-N
Molecular Formula C8H10O2
2

2-Phenoxyethanol, 99%

CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

EDGE
PubChem CID 31236
CAS 122-99-6
Molecular Weight (g/mol) 138.17
ChEBI CHEBI:64275
MDL Number MFCD00002857
SMILES C1=CC=C(C=C1)OCCO
Synonym phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
IUPAC Name 2-phenoxyethanol
InChI Key QCDWFXQBSFUVSP-UHFFFAOYSA-N
Molecular Formula C8H10O2
3

2-Benzyloxybenzoic acid, 98%

CAS: 14389-86-7 Molecular Formula: C14H11O3 Molecular Weight (g/mol): 227.24 MDL Number: MFCD00051940 InChI Key: GMOYUTKNPLBTMT-UHFFFAOYSA-M PubChem CID: 1810581 SMILES: [O-]C(=O)C1=CC=CC=C1OCC1=CC=CC=C1

PubChem CID 1810581
CAS 14389-86-7
Molecular Weight (g/mol) 227.24
MDL Number MFCD00051940
SMILES [O-]C(=O)C1=CC=CC=C1OCC1=CC=CC=C1
InChI Key GMOYUTKNPLBTMT-UHFFFAOYSA-M
Molecular Formula C14H11O3
4

2-Benzyloxyphenylacetic acid, 98+%

CAS: 22047-88-7 Molecular Formula: C15H13O3 Molecular Weight (g/mol): 241.27 MDL Number: MFCD00016822 InChI Key: BGTPJDGURCMYML-AWEZNQCLSA-M Synonym: 2-benzyloxyphenylacetic acid,o-benzyloxyphenylacetic acid,2-2-benzyloxy phenyl acetic acid,2-benzyloxy phenyl acetic acid,2-benzyloxyphenyl acetic acid,benzeneacetic acid,2-phenylmethoxy,2-2-phenylmethoxy phenyl acetic acid,acmc-20ao3j PubChem CID: 519916 SMILES: [O-]C(=O)[C@@H](OCC1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 519916
CAS 22047-88-7
Molecular Weight (g/mol) 241.27
MDL Number MFCD00016822
SMILES [O-]C(=O)[C@@H](OCC1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-benzyloxyphenylacetic acid,o-benzyloxyphenylacetic acid,2-2-benzyloxy phenyl acetic acid,2-benzyloxy phenyl acetic acid,2-benzyloxyphenyl acetic acid,benzeneacetic acid,2-phenylmethoxy,2-2-phenylmethoxy phenyl acetic acid,acmc-20ao3j
InChI Key BGTPJDGURCMYML-AWEZNQCLSA-M
Molecular Formula C15H13O3
5

2-Chlorophenyl phosphorodichloridate, 98+%

CAS: 15074-54-1 Molecular Formula: C6H4Cl3O2P Molecular Weight (g/mol): 245.42 MDL Number: MFCD00009704 InChI Key: VLDPXPPHXDGHEW-UHFFFAOYSA-N Synonym: 2-chlorophenyl phosphorodichloridate,2-chlorophenyl dichlorophosphate,o-chlorophenyl dichlorophosphate,phosphorodichloridic acid, 2-chlorophenyl ester,o-chlorophenyl phosphorodichloridate,2-chlorophenyl phosphoric acid dichloride,2-chlorophenyl chlorophosphonochloridate,acmc-20anxn,o-chlorophenylphosphonyl dichloride,2-chlorophenyl dichloridophosphate # PubChem CID: 84775 IUPAC Name: 1-chloro-2-dichlorophosphoryloxybenzene SMILES: C1=CC=C(C(=C1)OP(=O)(Cl)Cl)Cl

PubChem CID 84775
CAS 15074-54-1
Molecular Weight (g/mol) 245.42
MDL Number MFCD00009704
SMILES C1=CC=C(C(=C1)OP(=O)(Cl)Cl)Cl
Synonym 2-chlorophenyl phosphorodichloridate,2-chlorophenyl dichlorophosphate,o-chlorophenyl dichlorophosphate,phosphorodichloridic acid, 2-chlorophenyl ester,o-chlorophenyl phosphorodichloridate,2-chlorophenyl phosphoric acid dichloride,2-chlorophenyl chlorophosphonochloridate,acmc-20anxn,o-chlorophenylphosphonyl dichloride,2-chlorophenyl dichloridophosphate #
IUPAC Name 1-chloro-2-dichlorophosphoryloxybenzene
InChI Key VLDPXPPHXDGHEW-UHFFFAOYSA-N
Molecular Formula C6H4Cl3O2P
6

2-Ethoxybenzoic acid, 98%

CAS: 134-11-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002438 InChI Key: XDZMPRGFOOFSBL-UHFFFAOYSA-N Synonym: o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid PubChem CID: 67252 IUPAC Name: 2-ethoxybenzoic acid SMILES: CCOC1=CC=CC=C1C(O)=O

PubChem CID 67252
CAS 134-11-2
Molecular Weight (g/mol) 166.18
MDL Number MFCD00002438
SMILES CCOC1=CC=CC=C1C(O)=O
Synonym o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid
IUPAC Name 2-ethoxybenzoic acid
InChI Key XDZMPRGFOOFSBL-UHFFFAOYSA-N
Molecular Formula C9H10O3
7

1-Phenoxy-2-propanol, tech. 85%

CAS: 770-35-4 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00016861 InChI Key: IBLKWZIFZMJLFL-UHFFFAOYNA-N Synonym: 1-phenoxy-2-propanol,2-propanol, 1-phenoxy,phenoxyisopropanol,propylene phenoxetol,2-phenoxy-1-methylethanol,1-phenoxy-propan-2-ol,phenyl-.beta.-hydroxypropyl ether,dsstox_cid_7312,dsstox_rid_78402,dsstox_gsid_27312 PubChem CID: 92839 IUPAC Name: 1-phenoxypropan-2-ol SMILES: CC(O)COC1=CC=CC=C1

PubChem CID 92839
CAS 770-35-4
Molecular Weight (g/mol) 152.19
MDL Number MFCD00016861
SMILES CC(O)COC1=CC=CC=C1
Synonym 1-phenoxy-2-propanol,2-propanol, 1-phenoxy,phenoxyisopropanol,propylene phenoxetol,2-phenoxy-1-methylethanol,1-phenoxy-propan-2-ol,phenyl-.beta.-hydroxypropyl ether,dsstox_cid_7312,dsstox_rid_78402,dsstox_gsid_27312
IUPAC Name 1-phenoxypropan-2-ol
InChI Key IBLKWZIFZMJLFL-UHFFFAOYNA-N
Molecular Formula C9H12O2
8

Hydroquinone bis(2-hydroxyethyl) ether, 95%

CAS: 104-38-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00002861 InChI Key: WTPYFJNYAMXZJG-UHFFFAOYSA-N Synonym: hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol PubChem CID: 66912 IUPAC Name: 2-[4-(2-hydroxyethoxy)phenoxy]ethanol SMILES: C1=CC(=CC=C1OCCO)OCCO

PubChem CID 66912
CAS 104-38-1
Molecular Weight (g/mol) 198.218
MDL Number MFCD00002861
SMILES C1=CC(=CC=C1OCCO)OCCO
Synonym hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol
IUPAC Name 2-[4-(2-hydroxyethoxy)phenoxy]ethanol
InChI Key WTPYFJNYAMXZJG-UHFFFAOYSA-N
Molecular Formula C10H14O4
9

Hydroquinone bis(2-hydroxyethyl)ether, 98+%

CAS: 104-38-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00002861 InChI Key: WTPYFJNYAMXZJG-UHFFFAOYSA-N Synonym: hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol PubChem CID: 66912 IUPAC Name: 2-[4-(2-hydroxyethoxy)phenoxy]ethanol SMILES: C1=CC(=CC=C1OCCO)OCCO

PubChem CID 66912
CAS 104-38-1
Molecular Weight (g/mol) 198.22
MDL Number MFCD00002861
SMILES C1=CC(=CC=C1OCCO)OCCO
Synonym hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol
IUPAC Name 2-[4-(2-hydroxyethoxy)phenoxy]ethanol
InChI Key WTPYFJNYAMXZJG-UHFFFAOYSA-N
Molecular Formula C10H14O4
10

2-(Trifluoromethoxy)aniline, 97%, Thermo Scientific™

CAS: 1535-75-7 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00035959 InChI Key: ZFCOUBUSGHLCDT-UHFFFAOYSA-N Synonym: 2-trifluoromethoxy aniline,benzenamine, 2-trifluoromethoxy,2-trifluoromethoxy-phenylamine,o-trifluoromethoxy aniline,alpha,alpha,alpha-trifluoro-o-anisidine,o-trifluoromethoxyaniline,2-trifluoromethoxy aminobenzene,2-trifluoromethoxy phenylamine,2-trifluoromethoxy phenyl amine PubChem CID: 73754 IUPAC Name: 2-(trifluoromethoxy)aniline SMILES: C1=CC=C(C(=C1)N)OC(F)(F)F

PubChem CID 73754
CAS 1535-75-7
Molecular Weight (g/mol) 177.126
MDL Number MFCD00035959
SMILES C1=CC=C(C(=C1)N)OC(F)(F)F
Synonym 2-trifluoromethoxy aniline,benzenamine, 2-trifluoromethoxy,2-trifluoromethoxy-phenylamine,o-trifluoromethoxy aniline,alpha,alpha,alpha-trifluoro-o-anisidine,o-trifluoromethoxyaniline,2-trifluoromethoxy aminobenzene,2-trifluoromethoxy phenylamine,2-trifluoromethoxy phenyl amine
IUPAC Name 2-(trifluoromethoxy)aniline
InChI Key ZFCOUBUSGHLCDT-UHFFFAOYSA-N
Molecular Formula C7H6F3NO
11

2-(3-Methylphenoxy)ethanol, 98%, Thermo Scientific Chemicals

CAS: 13605-19-1 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00014035 InChI Key: FDBXUXVQIOQYIX-UHFFFAOYSA-N Synonym: 2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol PubChem CID: 83611 IUPAC Name: 2-(3-methylphenoxy)ethanol SMILES: CC1=CC(=CC=C1)OCCO

PubChem CID 83611
CAS 13605-19-1
Molecular Weight (g/mol) 152.193
MDL Number MFCD00014035
SMILES CC1=CC(=CC=C1)OCCO
Synonym 2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol
IUPAC Name 2-(3-methylphenoxy)ethanol
InChI Key FDBXUXVQIOQYIX-UHFFFAOYSA-N
Molecular Formula C9H12O2
12

3-(Pyridin-2-yloxy)aniline, 97%, Thermo Scientific™

CAS: 86556-09-4 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD06825506 InChI Key: CLQMOPKXIBQKKG-UHFFFAOYSA-N Synonym: 3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy PubChem CID: 13150573 IUPAC Name: 3-pyridin-2-yloxyaniline SMILES: NC1=CC(OC2=CC=CC=N2)=CC=C1

PubChem CID 13150573
CAS 86556-09-4
Molecular Weight (g/mol) 186.21
MDL Number MFCD06825506
SMILES NC1=CC(OC2=CC=CC=N2)=CC=C1
Synonym 3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy
IUPAC Name 3-pyridin-2-yloxyaniline
InChI Key CLQMOPKXIBQKKG-UHFFFAOYSA-N
Molecular Formula C11H10N2O
13

3-(Pyrid-2-yloxy)benzoic acid, 97%, Thermo Scientific™

CAS: 51362-30-2 Molecular Formula: C12H9NO3 Molecular Weight (g/mol): 215.208 MDL Number: MFCD09025853 InChI Key: LYSIEAIIZBZRCE-UHFFFAOYSA-N Synonym: 3-pyridin-2-yloxy benzoic acid,3-pyrid-2-yloxy benzoic acid,3-2-pyridyloxy benzoic acid,3-2 pyridyloxy-benzoic acid,3-pyridin-2-yl oxy benzoic acid,benzoic acid, 3-2-pyridinyloxy PubChem CID: 21901423 IUPAC Name: 3-pyridin-2-yloxybenzoic acid SMILES: C1=CC=NC(=C1)OC2=CC=CC(=C2)C(=O)O

PubChem CID 21901423
CAS 51362-30-2
Molecular Weight (g/mol) 215.208
MDL Number MFCD09025853
SMILES C1=CC=NC(=C1)OC2=CC=CC(=C2)C(=O)O
Synonym 3-pyridin-2-yloxy benzoic acid,3-pyrid-2-yloxy benzoic acid,3-2-pyridyloxy benzoic acid,3-2 pyridyloxy-benzoic acid,3-pyridin-2-yl oxy benzoic acid,benzoic acid, 3-2-pyridinyloxy
IUPAC Name 3-pyridin-2-yloxybenzoic acid
InChI Key LYSIEAIIZBZRCE-UHFFFAOYSA-N
Molecular Formula C12H9NO3
14

2-Phenoxyethanol, MP Biomedicals™

CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

PubChem CID 31236
CAS 122-99-6
Molecular Weight (g/mol) 138.166
ChEBI CHEBI:64275
SMILES C1=CC=C(C=C1)OCCO
Synonym phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
IUPAC Name 2-phenoxyethanol
InChI Key QCDWFXQBSFUVSP-UHFFFAOYSA-N
Molecular Formula C8H10O2
15

3-[(6-Methylpyrazin-2-yl)oxy]aniline, 97%, Thermo Scientific™

CAS: 915707-61-8 Molecular Formula: C11H11N3O Molecular Weight (g/mol): 201.229 MDL Number: MFCD09702406 InChI Key: ZFDWDKWQAXTCSU-UHFFFAOYSA-N PubChem CID: 24229682 IUPAC Name: 3-(6-methylpyrazin-2-yl)oxyaniline SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)N

PubChem CID 24229682
CAS 915707-61-8
Molecular Weight (g/mol) 201.229
MDL Number MFCD09702406
SMILES CC1=CN=CC(=N1)OC2=CC=CC(=C2)N
IUPAC Name 3-(6-methylpyrazin-2-yl)oxyaniline
InChI Key ZFDWDKWQAXTCSU-UHFFFAOYSA-N
Molecular Formula C11H11N3O