Benzenediols

Aromatic organic compounds that consist of a benzene ring with two hydroxyl functional group substitutions.

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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

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Specifications

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',4'-Dihydroxy-2-(4-hydroxyphenyl)acetophenone, 97%, Thermo Scientific Chemicals

CAS: 17720-60-4 Molecular Formula: C14H12O4 Molecular Weight (g/mol): 244.25 MDL Number: MFCD00498162 InChI Key: KLFCJXAPIFIIFR-UHFFFAOYSA-N Synonym: 1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl ethanone,2,4,4'-trihydroxydeoxybenzoin,2,4,4'-trihydroxy deoxybenzoin,1-2,4-dihydroxy-phenyl-2-4-hydroxy-phenyl-ethanone,1-2,4-dihydroxy-phenyl 2 4-hydro xy-phenyl-ethanone,ethanone,1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl,ethanone, 1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl,2,4,4'-terthydroxydeoxybenzoin,2,4,4-trihydroxydeoxybenzoin,2,4,4/'-trihydroxydeoxybenzoin PubChem CID: 640096 IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-(4-hydroxyphenyl)ethan-1-one SMILES: OC1=CC=C(CC(=O)C2=C(O)C=C(O)C=C2)C=C1

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Specifications

PubChem CID	640096
CAS	17720-60-4
Molecular Weight (g/mol)	244.25
MDL Number	MFCD00498162
SMILES	OC1=CC=C(CC(=O)C2=C(O)C=C(O)C=C2)C=C1
Synonym	1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl ethanone,2,4,4'-trihydroxydeoxybenzoin,2,4,4'-trihydroxy deoxybenzoin,1-2,4-dihydroxy-phenyl-2-4-hydroxy-phenyl-ethanone,1-2,4-dihydroxy-phenyl 2 4-hydro xy-phenyl-ethanone,ethanone,1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl,ethanone, 1-2,4-dihydroxyphenyl-2-4-hydroxyphenyl,2,4,4'-terthydroxydeoxybenzoin,2,4,4-trihydroxydeoxybenzoin,2,4,4/'-trihydroxydeoxybenzoin
IUPAC Name	1-(2,4-dihydroxyphenyl)-2-(4-hydroxyphenyl)ethan-1-one
InChI Key	KLFCJXAPIFIIFR-UHFFFAOYSA-N
Molecular Formula	C14H12O4

Isoprenaline hydrochloride, 98%, Thermo Scientific Chemicals

CAS: 51-30-9 Molecular Formula: C11H18ClNO3 Molecular Weight (g/mol): 247.72 MDL Number: MFCD00012603,MFCD00064548 InChI Key: IROWCYIEJAOFOW-UHFFFAOYNA-N Synonym: isoprenaline hydrochloride,isoproterenol hydrochloride,isuprel,euspiran,isoprenaline hcl,isoproterenol hcl,aerolone,aerotrol,izadrin,vapo-iso PubChem CID: 5807 IUPAC Name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;hydrochloride SMILES: [H+].[Cl-].CC(C)NCC(O)C1=CC=C(O)C(O)=C1

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Specifications

PubChem CID	5807
CAS	51-30-9
Molecular Weight (g/mol)	247.72
MDL Number	MFCD00012603,MFCD00064548
SMILES	[H+].[Cl-].CC(C)NCC(O)C1=CC=C(O)C(O)=C1
Synonym	isoprenaline hydrochloride,isoproterenol hydrochloride,isuprel,euspiran,isoprenaline hcl,isoproterenol hcl,aerolone,aerotrol,izadrin,vapo-iso
IUPAC Name	4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;hydrochloride
InChI Key	IROWCYIEJAOFOW-UHFFFAOYNA-N
Molecular Formula	C11H18ClNO3

3-Fluoro-1,2-dihydroxybenzene, 98+%, Thermo Scientific Chemicals

CAS: 363-52-0 Molecular Formula: C6H5FO2 Molecular Weight (g/mol): 128.10 MDL Number: MFCD00042582 InChI Key: DXOSJQLIRGXWCF-UHFFFAOYSA-N Synonym: 3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142 PubChem CID: 67764 ChEBI: CHEBI:39876 IUPAC Name: 3-fluorobenzene-1,2-diol SMILES: OC1=CC=CC(F)=C1O

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Specifications

PubChem CID	67764
CAS	363-52-0
Molecular Weight (g/mol)	128.10
ChEBI	CHEBI:39876
MDL Number	MFCD00042582
SMILES	OC1=CC=CC(F)=C1O
Synonym	3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142
IUPAC Name	3-fluorobenzene-1,2-diol
InChI Key	DXOSJQLIRGXWCF-UHFFFAOYSA-N
Molecular Formula	C6H5FO2

L(-)-Epinephrine, 99%

CAS: 51-43-4 MDL Number: MFCD00002204 InChI Key: UCTWMZQNUQWSLP-VIFPVBQESA-N Synonym: epinephrine,l-adrenaline,adrenaline,l-epinephrine,adrenalin,levoepinephrine,epinefrina,--adrenaline,adnephrine,chelafrin PubChem CID: 5816 ChEBI: CHEBI:28918 IUPAC Name: 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol SMILES: CNCC(C1=CC(=C(C=C1)O)O)O

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Specifications

PubChem CID	5816
CAS	51-43-4
ChEBI	CHEBI:28918
MDL Number	MFCD00002204
SMILES	CNCC(C1=CC(=C(C=C1)O)O)O
Synonym	epinephrine,l-adrenaline,adrenaline,l-epinephrine,adrenalin,levoepinephrine,epinefrina,--adrenaline,adnephrine,chelafrin
IUPAC Name	4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
InChI Key	UCTWMZQNUQWSLP-VIFPVBQESA-N

Hydroquinone, 99%

CAS: 123-31-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002339 InChI Key: QIGBRXMKCJKVMJ-UHFFFAOYSA-N Synonym: hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol PubChem CID: 785 ChEBI: CHEBI:17594 IUPAC Name: benzene-1,4-diol SMILES: C1=CC(=CC=C1O)O

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Specifications

PubChem CID	785
CAS	123-31-9
Molecular Weight (g/mol)	110.112
ChEBI	CHEBI:17594
MDL Number	MFCD00002339
SMILES	C1=CC(=CC=C1O)O
Synonym	hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol
IUPAC Name	benzene-1,4-diol
InChI Key	QIGBRXMKCJKVMJ-UHFFFAOYSA-N
Molecular Formula	C6H6O2

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

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Specifications

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

2-Nitroresorcinol, 98%

CAS: 601-89-8 Molecular Formula: C6H5NO4 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00007124 InChI Key: ZLCPKMIJYMHZMJ-UHFFFAOYSA-N Synonym: 2-nitroresorcinol,2-nitrobenzene-1,3-diol,1,3-benzenediol, 2-nitro,resorcinol, 2-nitro,2-nitro-1,3-benzenediol,1,3-dihydroxy-2-nitrobenzene,1,3-benzenediol, nitro,2,6-dihydroxynitrobenzene,nitroresorcinol,acmc-209mid PubChem CID: 11760 IUPAC Name: 2-nitrobenzene-1,3-diol SMILES: OC1=CC=CC(O)=C1[N+]([O-])=O

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Specifications

PubChem CID	11760
CAS	601-89-8
Molecular Weight (g/mol)	155.11
MDL Number	MFCD00007124
SMILES	OC1=CC=CC(O)=C1[N+]([O-])=O
Synonym	2-nitroresorcinol,2-nitrobenzene-1,3-diol,1,3-benzenediol, 2-nitro,resorcinol, 2-nitro,2-nitro-1,3-benzenediol,1,3-dihydroxy-2-nitrobenzene,1,3-benzenediol, nitro,2,6-dihydroxynitrobenzene,nitroresorcinol,acmc-209mid
IUPAC Name	2-nitrobenzene-1,3-diol
InChI Key	ZLCPKMIJYMHZMJ-UHFFFAOYSA-N
Molecular Formula	C6H5NO4

2,5-Dihydroxybenzoic acid, 99%

CAS: 490-79-9 Molecular Formula: C₇H₆O₄ Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002460 InChI Key: WXTMDXOMEHJXQO-UHFFFAOYSA-N Synonym: gentisic acid,hydroquinonecarboxylic acid,benzoic acid, 2,5-dihydroxy,5-hydroxysalicylic acid,gensigen,gensigon,gentisate,2,5-dioxybenzoic acid,2,5-dhba,gentisinic acid PubChem CID: 3469 ChEBI: CHEBI:17189 IUPAC Name: 2,5-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1O)C(=O)O)O

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Specifications

PubChem CID	3469
CAS	490-79-9
Molecular Weight (g/mol)	154.12
ChEBI	CHEBI:17189
MDL Number	MFCD00002460
SMILES	C1=CC(=C(C=C1O)C(=O)O)O
Synonym	gentisic acid,hydroquinonecarboxylic acid,benzoic acid, 2,5-dihydroxy,5-hydroxysalicylic acid,gensigen,gensigon,gentisate,2,5-dioxybenzoic acid,2,5-dhba,gentisinic acid
IUPAC Name	2,5-dihydroxybenzoic acid
InChI Key	WXTMDXOMEHJXQO-UHFFFAOYSA-N
Molecular Formula	C₇H₆O₄

2-Methylhydroquinone, 99%

CAS: 95-71-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00002345 InChI Key: CNHDIAIOKMXOLK-UHFFFAOYSA-N Synonym: methylhydroquinone,2-methylhydroquinone,2,5-dihydroxytoluene,p-toluhydroquinone,toluhydroquinone,toluquinol,p-toluquinol,tolylhydroquinone,p-toluhydroquinol,2,5-toluenediol PubChem CID: 7253 IUPAC Name: 2-methylbenzene-1,4-diol SMILES: CC1=CC(O)=CC=C1O

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Specifications

PubChem CID	7253
CAS	95-71-6
Molecular Weight (g/mol)	124.14
MDL Number	MFCD00002345
SMILES	CC1=CC(O)=CC=C1O
Synonym	methylhydroquinone,2-methylhydroquinone,2,5-dihydroxytoluene,p-toluhydroquinone,toluhydroquinone,toluquinol,p-toluquinol,tolylhydroquinone,p-toluhydroquinol,2,5-toluenediol
IUPAC Name	2-methylbenzene-1,4-diol
InChI Key	CNHDIAIOKMXOLK-UHFFFAOYSA-N
Molecular Formula	C7H8O2

4-Ethylcatechol, 98%

CAS: 1124-39-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00015847 InChI Key: HFLGBNBLMBSXEM-UHFFFAOYSA-N Synonym: 4-ethylcatechol,4-ethylpyrocatechol,4-ethyl-1,2-benzenediol,unii-574jv8byr2,1,2-benzenediol, 4-ethyl,benzenediol, 4-ethyl,3,4-dihydroxyethylbenzene,ethylcatechol,4-ethyl catechol,4-ethylc atechol PubChem CID: 70761 IUPAC Name: 4-ethylbenzene-1,2-diol SMILES: CCC1=CC=C(O)C(O)=C1

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Specifications

PubChem CID	70761
CAS	1124-39-6
Molecular Weight (g/mol)	138.17
MDL Number	MFCD00015847
SMILES	CCC1=CC=C(O)C(O)=C1
Synonym	4-ethylcatechol,4-ethylpyrocatechol,4-ethyl-1,2-benzenediol,unii-574jv8byr2,1,2-benzenediol, 4-ethyl,benzenediol, 4-ethyl,3,4-dihydroxyethylbenzene,ethylcatechol,4-ethyl catechol,4-ethylc atechol
IUPAC Name	4-ethylbenzene-1,2-diol
InChI Key	HFLGBNBLMBSXEM-UHFFFAOYSA-N
Molecular Formula	C8H10O2

3,5-Dihydroxybenzonitrile, 98%

CAS: 19179-36-3 Molecular Formula: C7H5NO2 Molecular Weight (g/mol): 135.12 MDL Number: MFCD00016453 InChI Key: ABHOEQJNEOMTEK-UHFFFAOYSA-N Synonym: benzonitrile, 3,5-dihydroxy,benzonitrile,3,5-dihydroxy,3,5-dihydroxy benzonitrile,5-cyanoresorcinol,a-resorcylonitrile,pubchem13116,acmc-1bouo PubChem CID: 87952 IUPAC Name: 3,5-dihydroxybenzonitrile SMILES: OC1=CC(=CC(O)=C1)C#N

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Specifications

PubChem CID	87952
CAS	19179-36-3
Molecular Weight (g/mol)	135.12
MDL Number	MFCD00016453
SMILES	OC1=CC(=CC(O)=C1)C#N
Synonym	benzonitrile, 3,5-dihydroxy,benzonitrile,3,5-dihydroxy,3,5-dihydroxy benzonitrile,5-cyanoresorcinol,a-resorcylonitrile,pubchem13116,acmc-1bouo
IUPAC Name	3,5-dihydroxybenzonitrile
InChI Key	ABHOEQJNEOMTEK-UHFFFAOYSA-N
Molecular Formula	C7H5NO2

4-Ethylresorcinol, 98%

CAS: 2896-60-8 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002283 InChI Key: VGMJYYDKPUPTID-UHFFFAOYSA-N Synonym: 4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol PubChem CID: 17927 IUPAC Name: 4-ethylbenzene-1,3-diol SMILES: CCC1=C(C=C(C=C1)O)O

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Specifications

PubChem CID	17927
CAS	2896-60-8
Molecular Weight (g/mol)	138.166
MDL Number	MFCD00002283
SMILES	CCC1=C(C=C(C=C1)O)O
Synonym	4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol
IUPAC Name	4-ethylbenzene-1,3-diol
InChI Key	VGMJYYDKPUPTID-UHFFFAOYSA-N
Molecular Formula	C8H10O2

Trimethylhydroquinone, 98%

CAS: 700-13-0 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00002346 InChI Key: AUFZRCJENRSRLY-UHFFFAOYSA-N Synonym: trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone PubChem CID: 12785 IUPAC Name: 2,3,5-trimethylbenzene-1,4-diol SMILES: CC1=CC(=C(C(=C1O)C)C)O

Pricing and Availability
Specifications

PubChem CID	12785
CAS	700-13-0
Molecular Weight (g/mol)	152.193
MDL Number	MFCD00002346
SMILES	CC1=CC(=C(C(=C1O)C)C)O
Synonym	trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone
IUPAC Name	2,3,5-trimethylbenzene-1,4-diol
InChI Key	AUFZRCJENRSRLY-UHFFFAOYSA-N
Molecular Formula	C9H12O2

Trimethylhydroquinone, 97%

CAS: 700-13-0 Molecular Formula: C₉H₁₂O₂ Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002346 InChI Key: AUFZRCJENRSRLY-UHFFFAOYSA-N Synonym: trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone PubChem CID: 12785 IUPAC Name: 2,3,5-trimethylbenzene-1,4-diol SMILES: CC1=CC(=C(C(=C1O)C)C)O

Pricing and Availability
Specifications

PubChem CID	12785
CAS	700-13-0
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00002346
SMILES	CC1=CC(=C(C(=C1O)C)C)O
Synonym	trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone
IUPAC Name	2,3,5-trimethylbenzene-1,4-diol
InChI Key	AUFZRCJENRSRLY-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂O₂

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