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Phenols

Aromatic organic compounds that consist of a phenyl functional group (−C6H5) bonded to a hydroxyl functional group (−OH). Includes compounds with more substitutions and derivatives.
Halophenols (536)
Benzenediols (331)
Cresols (277)
1-hydroxy-4-unsubstituted benzenoids (215)
1-hydroxy-2-unsubstituted benzenoids (206)
Aminophenols (131)
4-alkoxyphenols (89)
Nitrophenols (29)
Tyrosols and derivatives (27)
1 4-dihydroxy-2-halobenzenoids (18)
Benzenetriols and derivatives (17)

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1 – 15 of 960 results
1

p-Cresol, 99+%, pure

CAS: 106-44-5 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002376 InChI Key: IWDCLRJOBJJRNH-UHFFFAOYSA-N Synonym: p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene PubChem CID: 2879 ChEBI: CHEBI:17847 IUPAC Name: 4-methylphenol SMILES: CC1=CC=C(C=C1)O

PubChem CID 2879
CAS 106-44-5
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17847
MDL Number MFCD00002376
SMILES CC1=CC=C(C=C1)O
Synonym p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene
IUPAC Name 4-methylphenol
InChI Key IWDCLRJOBJJRNH-UHFFFAOYSA-N
Molecular Formula C7H8O
2

3,4-Dihydroxybenzoic acid, 97%

CAS: 99-50-3 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002509 InChI Key: YQUVCSBJEUQKSH-UHFFFAOYSA-N Synonym: protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537 PubChem CID: 72 ChEBI: CHEBI:36062 IUPAC Name: 3,4-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)O)O

PubChem CID 72
CAS 99-50-3
Molecular Weight (g/mol) 154.12
ChEBI CHEBI:36062
MDL Number MFCD00002509
SMILES C1=CC(=C(C=C1C(=O)O)O)O
Synonym protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537
IUPAC Name 3,4-dihydroxybenzoic acid
InChI Key YQUVCSBJEUQKSH-UHFFFAOYSA-N
Molecular Formula C7H6O4
3

2-Fluorophenol, 98%

CAS: 367-12-4 Molecular Formula: C6H5FO Molecular Weight (g/mol): 112.10 MDL Number: MFCD00002155 InChI Key: HFHFGHLXUCOHLN-UHFFFAOYSA-N Synonym: o-fluorophenol,phenol, 2-fluoro,phenol, o-fluoro,1-fluoro-2-hydroxybenzene,2-fluorohydroxybenzene,fluorophenol,unii-i9ow1nly9r,2-fluoro-phenol,phenol, fluoro,ccris 1226 PubChem CID: 9707 IUPAC Name: 2-fluorophenol SMILES: OC1=CC=CC=C1F

PubChem CID 9707
CAS 367-12-4
Molecular Weight (g/mol) 112.10
MDL Number MFCD00002155
SMILES OC1=CC=CC=C1F
Synonym o-fluorophenol,phenol, 2-fluoro,phenol, o-fluoro,1-fluoro-2-hydroxybenzene,2-fluorohydroxybenzene,fluorophenol,unii-i9ow1nly9r,2-fluoro-phenol,phenol, fluoro,ccris 1226
IUPAC Name 2-fluorophenol
InChI Key HFHFGHLXUCOHLN-UHFFFAOYSA-N
Molecular Formula C6H5FO
4

4-Fluorophenol, 99%

CAS: 371-41-5 Molecular Formula: C6H5FO Molecular Weight (g/mol): 112.10 MDL Number: MFCD00002316 InChI Key: RHMPLDJJXGPMEX-UHFFFAOYSA-N Synonym: p-fluorophenol,phenol, 4-fluoro,phenol, p-fluoro,para-fluorophenol,4-fluoro phenol,4-fluoro-phenol,ccris 665,4-fluoranylphenol,fpn PubChem CID: 9732 IUPAC Name: 4-fluorophenol SMILES: OC1=CC=C(F)C=C1

PubChem CID 9732
CAS 371-41-5
Molecular Weight (g/mol) 112.10
MDL Number MFCD00002316
SMILES OC1=CC=C(F)C=C1
Synonym p-fluorophenol,phenol, 4-fluoro,phenol, p-fluoro,para-fluorophenol,4-fluoro phenol,4-fluoro-phenol,ccris 665,4-fluoranylphenol,fpn
IUPAC Name 4-fluorophenol
InChI Key RHMPLDJJXGPMEX-UHFFFAOYSA-N
Molecular Formula C6H5FO
5

Guaiacol, 99+%

CAS: 90-05-1 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 InChI Key: LHGVFZTZFXWLCP-UHFFFAOYSA-N Synonym: guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid PubChem CID: 460 ChEBI: CHEBI:28591 IUPAC Name: 2-methoxyphenol SMILES: COC1=CC=CC=C1O

PubChem CID 460
CAS 90-05-1
Molecular Weight (g/mol) 124.14
ChEBI CHEBI:28591
SMILES COC1=CC=CC=C1O
Synonym guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid
IUPAC Name 2-methoxyphenol
InChI Key LHGVFZTZFXWLCP-UHFFFAOYSA-N
Molecular Formula C7H8O2
6

Methyl caffeate

CAS: 3843-74-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00210468 InChI Key: OCNYGKNIVPVPPX-HWKANZROSA-N Synonym: methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 PubChem CID: 689075 ChEBI: CHEBI:6856 IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC(=C(C=C1)O)O

PubChem CID 689075
CAS 3843-74-1
Molecular Weight (g/mol) 194.186
ChEBI CHEBI:6856
MDL Number MFCD00210468
SMILES COC(=O)C=CC1=CC(=C(C=C1)O)O
Synonym methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001
IUPAC Name methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChI Key OCNYGKNIVPVPPX-HWKANZROSA-N
Molecular Formula C10H10O4
7

4-Hexylresorcinol, 98%

CAS: 136-77-6 Molecular Formula: C12H18O2 Molecular Weight (g/mol): 194.27 MDL Number: MFCD00002284 InChI Key: WFJIVOKAWHGMBH-UHFFFAOYSA-N Synonym: hexylresorcinol,4-hexylresorcinol,antascarin,ascaricid,ascarinol,4-n-hexylresorcinol,oxana,p-hexylresorcinol,adrover,caprokol PubChem CID: 3610 IUPAC Name: 4-hexylbenzene-1,3-diol SMILES: CCCCCCC1=CC=C(O)C=C1O

PubChem CID 3610
CAS 136-77-6
Molecular Weight (g/mol) 194.27
MDL Number MFCD00002284
SMILES CCCCCCC1=CC=C(O)C=C1O
Synonym hexylresorcinol,4-hexylresorcinol,antascarin,ascaricid,ascarinol,4-n-hexylresorcinol,oxana,p-hexylresorcinol,adrover,caprokol
IUPAC Name 4-hexylbenzene-1,3-diol
InChI Key WFJIVOKAWHGMBH-UHFFFAOYSA-N
Molecular Formula C12H18O2
8

4-Hydroxybenzonitrile, 98+%

CAS: 767-00-0 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.123 MDL Number: MFCD00002312 InChI Key: CVNOWLNNPYYEOH-UHFFFAOYSA-N Synonym: 4-cyanophenol,p-hydroxybenzonitrile,p-cyanophenol,benzonitrile, 4-hydroxy,benzonitrile, p-hydroxy,4-cyano phenol,4-hydroxybenzoic acid nitrile,4-hydroxy-benzonitrile,4-hydroxy benzonitrile,4-hydroxybenzenecarbonitrile PubChem CID: 13019 ChEBI: CHEBI:38622 IUPAC Name: 4-hydroxybenzonitrile SMILES: C1=CC(=CC=C1C#N)O

PubChem CID 13019
CAS 767-00-0
Molecular Weight (g/mol) 119.123
ChEBI CHEBI:38622
MDL Number MFCD00002312
SMILES C1=CC(=CC=C1C#N)O
Synonym 4-cyanophenol,p-hydroxybenzonitrile,p-cyanophenol,benzonitrile, 4-hydroxy,benzonitrile, p-hydroxy,4-cyano phenol,4-hydroxybenzoic acid nitrile,4-hydroxy-benzonitrile,4-hydroxy benzonitrile,4-hydroxybenzenecarbonitrile
IUPAC Name 4-hydroxybenzonitrile
InChI Key CVNOWLNNPYYEOH-UHFFFAOYSA-N
Molecular Formula C7H5NO
9

2-Hydroxy-5-methoxybenzaldehyde, 98%

CAS: 672-13-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00003332 InChI Key: FZHSPPYCNDYIKD-UHFFFAOYSA-N Synonym: 5-methoxysalicylaldehyde,m-anisaldehyde, 6-hydroxy,benzaldehyde, 2-hydroxy-5-methoxy,salicylaldehyde, 5-methoxy,6-hydroxy-m-anisaldehyde,2-hydroxy-5-methoxy-benzaldehyde,5-methoxy-2-hydroxybenzaldehyde,2-hydroxy-5-methoxy benzaldehyde,2-formyl-4-methoxyphenol,pubchem2649 PubChem CID: 95695 IUPAC Name: 2-hydroxy-5-methoxybenzaldehyde SMILES: COC1=CC(=C(C=C1)O)C=O

PubChem CID 95695
CAS 672-13-9
Molecular Weight (g/mol) 152.149
MDL Number MFCD00003332
SMILES COC1=CC(=C(C=C1)O)C=O
Synonym 5-methoxysalicylaldehyde,m-anisaldehyde, 6-hydroxy,benzaldehyde, 2-hydroxy-5-methoxy,salicylaldehyde, 5-methoxy,6-hydroxy-m-anisaldehyde,2-hydroxy-5-methoxy-benzaldehyde,5-methoxy-2-hydroxybenzaldehyde,2-hydroxy-5-methoxy benzaldehyde,2-formyl-4-methoxyphenol,pubchem2649
IUPAC Name 2-hydroxy-5-methoxybenzaldehyde
InChI Key FZHSPPYCNDYIKD-UHFFFAOYSA-N
Molecular Formula C8H8O3
10

3,4-Dihydroxyphenylacetic acid, 98+%

CAS: 102-32-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00004338 InChI Key: CFFZDZCDUFSOFZ-UHFFFAOYSA-N Synonym: 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate PubChem CID: 547 ChEBI: CHEBI:41941 IUPAC Name: 2-(3,4-dihydroxyphenyl)acetic acid SMILES: C1=CC(=C(C=C1CC(=O)O)O)O

PubChem CID 547
CAS 102-32-9
Molecular Weight (g/mol) 168.148
ChEBI CHEBI:41941
MDL Number MFCD00004338
SMILES C1=CC(=C(C=C1CC(=O)O)O)O
Synonym 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate
IUPAC Name 2-(3,4-dihydroxyphenyl)acetic acid
InChI Key CFFZDZCDUFSOFZ-UHFFFAOYSA-N
Molecular Formula C8H8O4
11

3,4-Dihydroxycinnamic acid, predominantly trans, 98+%

CAS: 331-39-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00004392 InChI Key: QAIPRVGONGVQAS-DUXPYHPUSA-N Synonym: caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid PubChem CID: 689043 ChEBI: CHEBI:16433 IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=C(C=C1C=CC(=O)O)O)O

PubChem CID 689043
CAS 331-39-5
Molecular Weight (g/mol) 180.159
ChEBI CHEBI:16433
MDL Number MFCD00004392
SMILES C1=CC(=C(C=C1C=CC(=O)O)O)O
Synonym caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid
IUPAC Name (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
InChI Key QAIPRVGONGVQAS-DUXPYHPUSA-N
Molecular Formula C9H8O4
12

4-Fluoro-2-nitrophenol, 98+%

CAS: 394-33-2 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.1 MDL Number: MFCD00042528 InChI Key: ZHRLVDHMIJDWSS-UHFFFAOYSA-N Synonym: 2-nitro-4-fluorophenol,phenol, 4-fluoro-2-nitro,phenol,2-nitro,4-fluoro,4-fluoro-2-nitro-phenol,4-fluoronitrophenol,pubchem1503,acmc-1ah4y,ksc493s6p,5-fluoro-2-hydroxynitrobenzene,4-fluoro-2-nitrophenol PubChem CID: 136236 IUPAC Name: 4-fluoro-2-nitrophenol SMILES: C1=CC(=C(C=C1F)[N+](=O)[O-])O

PubChem CID 136236
CAS 394-33-2
Molecular Weight (g/mol) 157.1
MDL Number MFCD00042528
SMILES C1=CC(=C(C=C1F)[N+](=O)[O-])O
Synonym 2-nitro-4-fluorophenol,phenol, 4-fluoro-2-nitro,phenol,2-nitro,4-fluoro,4-fluoro-2-nitro-phenol,4-fluoronitrophenol,pubchem1503,acmc-1ah4y,ksc493s6p,5-fluoro-2-hydroxynitrobenzene,4-fluoro-2-nitrophenol
IUPAC Name 4-fluoro-2-nitrophenol
InChI Key ZHRLVDHMIJDWSS-UHFFFAOYSA-N
Molecular Formula C6H4FNO3
13

4-Fluoro-2-methylphenol, 98%

CAS: 452-72-2 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00075088 InChI Key: GKQDDKKGDIVDAG-UHFFFAOYSA-N Synonym: 2-methyl-4-fluorophenol,4-fluoro-o-cresol,4-fluoro-2-methyl-phenol,5-fluoro-2-hydroxytoluene,phenol, 4-fluoro-2-methyl,pubchem1500,acmc-1csjj,4-fuoro-2-methyl-phenol,2-methyl-4-fluoro phenol,4-fluoro-2-methyl phenol PubChem CID: 136295 IUPAC Name: 4-fluoro-2-methylphenol SMILES: CC1=C(C=CC(=C1)F)O

PubChem CID 136295
CAS 452-72-2
Molecular Weight (g/mol) 126.13
MDL Number MFCD00075088
SMILES CC1=C(C=CC(=C1)F)O
Synonym 2-methyl-4-fluorophenol,4-fluoro-o-cresol,4-fluoro-2-methyl-phenol,5-fluoro-2-hydroxytoluene,phenol, 4-fluoro-2-methyl,pubchem1500,acmc-1csjj,4-fuoro-2-methyl-phenol,2-methyl-4-fluoro phenol,4-fluoro-2-methyl phenol
IUPAC Name 4-fluoro-2-methylphenol
InChI Key GKQDDKKGDIVDAG-UHFFFAOYSA-N
Molecular Formula C7H7FO
14

2-Bromo-4-chlorophenol, 98+%

CAS: 695-96-5 Molecular Formula: C6H4BrClO Molecular Weight (g/mol): 207.45 MDL Number: MFCD00002319 InChI Key: ZIYRDJLAJYTELF-UHFFFAOYSA-N Synonym: phenol, 2-bromo-4-chloro,4-chloro-2-bromophenol,2-bromo-4-chloro-phenol,4-chloro-2-bromo phenol,pubchem3594,2-bromo-4-chorophenol,acmc-1ayt0,akos bbb/602,ksc493o9n,2-bromo-4-chlorophenol PubChem CID: 69670 IUPAC Name: 2-bromo-4-chlorophenol SMILES: OC1=CC=C(Cl)C=C1Br

PubChem CID 69670
CAS 695-96-5
Molecular Weight (g/mol) 207.45
MDL Number MFCD00002319
SMILES OC1=CC=C(Cl)C=C1Br
Synonym phenol, 2-bromo-4-chloro,4-chloro-2-bromophenol,2-bromo-4-chloro-phenol,4-chloro-2-bromo phenol,pubchem3594,2-bromo-4-chorophenol,acmc-1ayt0,akos bbb/602,ksc493o9n,2-bromo-4-chlorophenol
IUPAC Name 2-bromo-4-chlorophenol
InChI Key ZIYRDJLAJYTELF-UHFFFAOYSA-N
Molecular Formula C6H4BrClO
15

2,6-Dichloro-4-fluorophenol, 98%

CAS: 392-71-2 Molecular Formula: C6H3Cl2FO Molecular Weight (g/mol): 180.987 MDL Number: MFCD00010675 InChI Key: BOJVIFKSTRCIRJ-UHFFFAOYSA-N PubChem CID: 94950 IUPAC Name: 2,6-dichloro-4-fluorophenol SMILES: C1=C(C=C(C(=C1Cl)O)Cl)F

PubChem CID 94950
CAS 392-71-2
Molecular Weight (g/mol) 180.987
MDL Number MFCD00010675
SMILES C1=C(C=C(C(=C1Cl)O)Cl)F
IUPAC Name 2,6-dichloro-4-fluorophenol
InChI Key BOJVIFKSTRCIRJ-UHFFFAOYSA-N
Molecular Formula C6H3Cl2FO