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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 (408)
Benzenediols (169)
Cresols (165)
1-hydroxy-2-unsubstituted benzenoids (113)
1-hydroxy-4-unsubstituted benzenoids (113)
4-alkoxyphenols (71)
Aminophenols (67)
Tyrosols and derivatives (14)
Nitrophenols (13)
Benzenetriols and derivatives (12)
1 4-dihydroxy-2-halobenzenoids (10)

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1 – 15 of 484 results
1

2,4-Dihydroxybenzoic acid, 97%

CAS: 89-86-1 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.121 MDL Number: MFCD00002451 InChI Key: UIAFKZKHHVMJGS-UHFFFAOYSA-N Synonym: beta-resorcylic acid,p-hydroxysalicylic acid,4-carboxyresorcinol,4-hydroxysalicylic acid,benzoic acid, 2,4-dihydroxy,beta-resorcinolic acid,2,4-dhba,resorcylic acid, beta,b-resorcylic acid,2,4-dihydroxy-benzoic acid PubChem CID: 1491 IUPAC Name: 2,4-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1O)O)C(=O)O

EDGE
PubChem CID 1491
CAS 89-86-1
Molecular Weight (g/mol) 154.121
MDL Number MFCD00002451
SMILES C1=CC(=C(C=C1O)O)C(=O)O
Synonym beta-resorcylic acid,p-hydroxysalicylic acid,4-carboxyresorcinol,4-hydroxysalicylic acid,benzoic acid, 2,4-dihydroxy,beta-resorcinolic acid,2,4-dhba,resorcylic acid, beta,b-resorcylic acid,2,4-dihydroxy-benzoic acid
IUPAC Name 2,4-dihydroxybenzoic acid
InChI Key UIAFKZKHHVMJGS-UHFFFAOYSA-N
Molecular Formula C7H6O4
2

3,5-Dinitrosalicylic acid, 97+%

CAS: 609-99-4 Molecular Formula: C7H4N2O7 Molecular Weight (g/mol): 228.116 MDL Number: MFCD00007104 InChI Key: LWFUFLREGJMOIZ-UHFFFAOYSA-N Synonym: 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid PubChem CID: 11873 ChEBI: CHEBI:53648 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]

EDGE
PubChem CID 11873
CAS 609-99-4
Molecular Weight (g/mol) 228.116
ChEBI CHEBI:53648
MDL Number MFCD00007104
SMILES C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]
Synonym 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid
InChI Key LWFUFLREGJMOIZ-UHFFFAOYSA-N
Molecular Formula C7H4N2O7
3

Alpha-(Chloromethyl)-3-hydroxybenzenemethanol, TRC

CAS: 1378757-22-2 Molecular Formula: C8H9ClO2 Molecular Weight (g/mol): 172.61 Synonym: α-(Chloromethyl)-3-hydroxybenzenemethanol,(RS)-2-Chloro-1-(3-hydroxyphenyl)ethanol IUPAC Name: 3-(2-chloro-1-hydroxyethyl)phenol SMILES: OC(CCl)c1cccc(O)c1

CAS 1378757-22-2
Molecular Weight (g/mol) 172.61
SMILES OC(CCl)c1cccc(O)c1
Synonym α-(Chloromethyl)-3-hydroxybenzenemethanol,(RS)-2-Chloro-1-(3-hydroxyphenyl)ethanol
IUPAC Name 3-(2-chloro-1-hydroxyethyl)phenol
Molecular Formula C8H9ClO2
4

4-Aminophenol, 98%

CAS: 123-30-8 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.128 MDL Number: MFCD00007869 InChI Key: PLIKAWJENQZMHA-UHFFFAOYSA-N Synonym: p-aminophenol,4-hydroxyaniline,p-hydroxyaniline,phenol, 4-amino,paranol,4-aminobenzenol,certinal,citol,azol,fouramine p PubChem CID: 403 ChEBI: CHEBI:17602 IUPAC Name: 4-aminophenol SMILES: C1=CC(=CC=C1N)O

PubChem CID 403
CAS 123-30-8
Molecular Weight (g/mol) 109.128
ChEBI CHEBI:17602
MDL Number MFCD00007869
SMILES C1=CC(=CC=C1N)O
Synonym p-aminophenol,4-hydroxyaniline,p-hydroxyaniline,phenol, 4-amino,paranol,4-aminobenzenol,certinal,citol,azol,fouramine p
IUPAC Name 4-aminophenol
InChI Key PLIKAWJENQZMHA-UHFFFAOYSA-N
Molecular Formula C6H7NO
5

4-Nitrophenol, 99%

CAS: 100-02-7 Molecular Formula: C6H5NO3 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00007331 InChI Key: BTJIUGUIPKRLHP-UHFFFAOYSA-N Synonym: p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo PubChem CID: 980 ChEBI: CHEBI:16836 IUPAC Name: 4-nitrophenol SMILES: OC1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 980
CAS 100-02-7
Molecular Weight (g/mol) 139.11
ChEBI CHEBI:16836
MDL Number MFCD00007331
SMILES OC1=CC=C(C=C1)[N+]([O-])=O
Synonym p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo
IUPAC Name 4-nitrophenol
InChI Key BTJIUGUIPKRLHP-UHFFFAOYSA-N
Molecular Formula C6H5NO3
6

Resorcinol, 99%

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O

PubChem CID 5054
CAS 108-46-3
Molecular Weight (g/mol) 110.112
ChEBI CHEBI:27810
MDL Number MFCD00002269
SMILES C1=CC(=CC(=C1)O)O
Synonym resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
7

Catechol, 99%

CAS: 120-80-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002188 InChI Key: YCIMNLLNPGFGHC-UHFFFAOYSA-N Synonym: pyrocatechol,catechol,1,2-dihydroxybenzene,1,2-benzenediol,pyrocatechin,2-hydroxyphenol,o-benzenediol,pyrocatechine,o-dihydroxybenzene,o-dioxybenzene PubChem CID: 289 ChEBI: CHEBI:18135 IUPAC Name: benzene-1,2-diol SMILES: OC1=CC=CC=C1O

PubChem CID 289
CAS 120-80-9
Molecular Weight (g/mol) 110.11
ChEBI CHEBI:18135
MDL Number MFCD00002188
SMILES OC1=CC=CC=C1O
Synonym pyrocatechol,catechol,1,2-dihydroxybenzene,1,2-benzenediol,pyrocatechin,2-hydroxyphenol,o-benzenediol,pyrocatechine,o-dihydroxybenzene,o-dioxybenzene
IUPAC Name benzene-1,2-diol
InChI Key YCIMNLLNPGFGHC-UHFFFAOYSA-N
Molecular Formula C6H6O2
8

4-(Pentafluorothio)phenol, 97%

CAS: 774-94-7 Molecular Formula: C6H5F5OS Molecular Weight (g/mol): 220.16 MDL Number: MFCD03788516 InChI Key: XHJLGVIUMCBMHL-UHFFFAOYSA-N Synonym: 4-pentafluorothio phenol,4-pentafluorosulfanyl phenol,4-hydroxyphenylsulfur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl phenol,4-pentafluoro-lambda∼6∼-sulfanyl phenol,sulfur,pentafluoro 4-hydroxyphenyl-, oc-6-21-9ci,4-pentafluorosulfanylphenol,4-pentafluorosulfur phenol,4-pentafluorosulphanyl phenol,4-pentafluorothio vi phenol PubChem CID: 2779203 IUPAC Name: 4-(pentafluoro-$l^{6}-sulfanyl)phenol SMILES: OC1=CC=C(C=C1)S(F)(F)(F)(F)F

PubChem CID 2779203
CAS 774-94-7
Molecular Weight (g/mol) 220.16
MDL Number MFCD03788516
SMILES OC1=CC=C(C=C1)S(F)(F)(F)(F)F
Synonym 4-pentafluorothio phenol,4-pentafluorosulfanyl phenol,4-hydroxyphenylsulfur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl phenol,4-pentafluoro-lambda∼6∼-sulfanyl phenol,sulfur,pentafluoro 4-hydroxyphenyl-, oc-6-21-9ci,4-pentafluorosulfanylphenol,4-pentafluorosulfur phenol,4-pentafluorosulphanyl phenol,4-pentafluorothio vi phenol
IUPAC Name 4-(pentafluoro-$l^{6}-sulfanyl)phenol
InChI Key XHJLGVIUMCBMHL-UHFFFAOYSA-N
Molecular Formula C6H5F5OS
9

Quinhydrone, 97%

CAS: 106-34-3 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00010310 InChI Key: BDJXVNRFAQSMAA-UHFFFAOYSA-N Synonym: quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1 PubChem CID: 7801 ChEBI: CHEBI:26491 IUPAC Name: benzene-1,4-diol;cyclohexa-2,5-diene-1,4-dione SMILES: OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1

PubChem CID 7801
CAS 106-34-3
Molecular Weight (g/mol) 218.21
ChEBI CHEBI:26491
MDL Number MFCD00010310
SMILES OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1
Synonym quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1
IUPAC Name benzene-1,4-diol;cyclohexa-2,5-diene-1,4-dione
InChI Key BDJXVNRFAQSMAA-UHFFFAOYSA-N
Molecular Formula C12H10O4
10

2,4,6-Triiodophenol, 98%

CAS: 609-23-4 Molecular Formula: C6H3I3O Molecular Weight (g/mol): 471.802 MDL Number: MFCD00002179 InChI Key: VAPDZNUFNKUROY-UHFFFAOYSA-N Synonym: phenol, 2,4,6-triiodo,triiodophenol,unii-9rb2r81a7u,2,4,6-trijodfenol,2,4,6-trijodfenol czech,2,4,6-triiodo-phenol,chembl81721,2,4,6-triiodo-phenol tip,2,6-triiodophenol,phenol,4,6-triiodo PubChem CID: 11862 IUPAC Name: 2,4,6-triiodophenol SMILES: C1=C(C=C(C(=C1I)O)I)I

PubChem CID 11862
CAS 609-23-4
Molecular Weight (g/mol) 471.802
MDL Number MFCD00002179
SMILES C1=C(C=C(C(=C1I)O)I)I
Synonym phenol, 2,4,6-triiodo,triiodophenol,unii-9rb2r81a7u,2,4,6-trijodfenol,2,4,6-trijodfenol czech,2,4,6-triiodo-phenol,chembl81721,2,4,6-triiodo-phenol tip,2,6-triiodophenol,phenol,4,6-triiodo
IUPAC Name 2,4,6-triiodophenol
InChI Key VAPDZNUFNKUROY-UHFFFAOYSA-N
Molecular Formula C6H3I3O
11

4-(4-Hydroxyphenyl)-2-butanone, 98%

CAS: 5471-51-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002394 InChI Key: NJGBTKGETPDVIK-UHFFFAOYSA-N Synonym: 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone PubChem CID: 21648 ChEBI: CHEBI:68656 IUPAC Name: 4-(4-hydroxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC=C(C=C1)O

PubChem CID 21648
CAS 5471-51-2
Molecular Weight (g/mol) 164.204
ChEBI CHEBI:68656
MDL Number MFCD00002394
SMILES CC(=O)CCC1=CC=C(C=C1)O
Synonym 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone
IUPAC Name 4-(4-hydroxyphenyl)butan-2-one
InChI Key NJGBTKGETPDVIK-UHFFFAOYSA-N
Molecular Formula C10H12O2
12

4,4'-(Hexafluoroisopropylidene)diphenol, 98%

CAS: 1478-61-1 Molecular Formula: C15H10F6O2 Molecular Weight (g/mol): 336.23 MDL Number: MFCD00000439 InChI Key: ZFVMWEVVKGLCIJ-UHFFFAOYSA-N Synonym: bisphenol af,4,4'-hexafluoroisopropylidene diphenol,2,2-bis 4-hydroxyphenyl hexafluoropropane,hexafluorobisphenol a,biphenol af,4,4'-perfluoropropane-2,2-diyl diphenol,hexafluoroisopropylidenebis 4-hydroxybenzene,hexafluorodiphenylolpropane,hexafluoroacetone bisphenol a,2,2-bis 4-hydroxyphenyl perfluoropropane PubChem CID: 73864 ChEBI: CHEBI:72754 IUPAC Name: 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol SMILES: OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)(C(F)(F)F)C(F)(F)F

PubChem CID 73864
CAS 1478-61-1
Molecular Weight (g/mol) 336.23
ChEBI CHEBI:72754
MDL Number MFCD00000439
SMILES OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)(C(F)(F)F)C(F)(F)F
Synonym bisphenol af,4,4'-hexafluoroisopropylidene diphenol,2,2-bis 4-hydroxyphenyl hexafluoropropane,hexafluorobisphenol a,biphenol af,4,4'-perfluoropropane-2,2-diyl diphenol,hexafluoroisopropylidenebis 4-hydroxybenzene,hexafluorodiphenylolpropane,hexafluoroacetone bisphenol a,2,2-bis 4-hydroxyphenyl perfluoropropane
IUPAC Name 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol
InChI Key ZFVMWEVVKGLCIJ-UHFFFAOYSA-N
Molecular Formula C15H10F6O2
13

2-Methylresorcinol, 98%

CAS: 608-25-3 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00002271 InChI Key: ZTMADXFOCUXMJE-UHFFFAOYSA-N Synonym: 2-methylresorcinol,2,6-dihydroxytoluene,1,3-benzenediol, 2-methyl,2-methylresorcin,resorcinol, 2-methyl,toluene-2,6-diol,2-methyl-1,3-benzenediol,1,3-dihydroxy-2-methylbenzene,1,3-benzenediol, methyl,2-methyl resorcinol PubChem CID: 11843 IUPAC Name: 2-methylbenzene-1,3-diol SMILES: CC1=C(C=CC=C1O)O

PubChem CID 11843
CAS 608-25-3
Molecular Weight (g/mol) 124.139
MDL Number MFCD00002271
SMILES CC1=C(C=CC=C1O)O
Synonym 2-methylresorcinol,2,6-dihydroxytoluene,1,3-benzenediol, 2-methyl,2-methylresorcin,resorcinol, 2-methyl,toluene-2,6-diol,2-methyl-1,3-benzenediol,1,3-dihydroxy-2-methylbenzene,1,3-benzenediol, methyl,2-methyl resorcinol
IUPAC Name 2-methylbenzene-1,3-diol
InChI Key ZTMADXFOCUXMJE-UHFFFAOYSA-N
Molecular Formula C7H8O2
14

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
15

2-Aminophenol, 99%

CAS: 95-55-6 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.128 MDL Number: MFCD00007690 InChI Key: CDAWCLOXVUBKRW-UHFFFAOYSA-N Synonym: o-aminophenol,o-hydroxyaniline,2-hydroxyaniline,phenol, 2-amino,2-amino-1-hydroxybenzene,fouramine op,benzofur gg,pelagol grey gg,pelagol 3ga,nako yellow 3ga PubChem CID: 5801 ChEBI: CHEBI:18112 IUPAC Name: 2-aminophenol SMILES: C1=CC=C(C(=C1)N)O

PubChem CID 5801
CAS 95-55-6
Molecular Weight (g/mol) 109.128
ChEBI CHEBI:18112
MDL Number MFCD00007690
SMILES C1=CC=C(C(=C1)N)O
Synonym o-aminophenol,o-hydroxyaniline,2-hydroxyaniline,phenol, 2-amino,2-amino-1-hydroxybenzene,fouramine op,benzofur gg,pelagol grey gg,pelagol 3ga,nako yellow 3ga
IUPAC Name 2-aminophenol
InChI Key CDAWCLOXVUBKRW-UHFFFAOYSA-N
Molecular Formula C6H7NO