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Benzenediols

Aromatic organic compounds that consist of a benzene ring with two hydroxyl functional group substitutions.
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1 – 15 of 37 results
1
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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

EDGE
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
2
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3,4-Dihydroxycinnamic acid, 99+%, predominantly trans isomer

CAS: 331-39-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 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

EDGE
PubChem CID 689043
CAS 331-39-5
Molecular Weight (g/mol) 180.16
ChEBI CHEBI:16433
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
3

5-Aminobenzene-1,3-diol hydrochloride, Technical Grade, Thermo Scientific™

CAS: 6318-56-5 Molecular Formula: C6H8ClNO2 Molecular Weight (g/mol): 161.59 MDL Number: MFCD00662897 InChI Key: VNZZCDQPCQIUGG-UHFFFAOYSA-N Synonym: 5-aminobenzene-1,3-diol hydrochloride,1,3-benzenediol, 5-amino-, hydrochloride,5-aminoresorcinol, hydrochloride,pubchem19962,5-aminobenzene-1,3-diol hcl,5-aminobenzene-1,3-diol hydrochloridyl PubChem CID: 459248 SMILES: Cl.NC1=CC(O)=CC(O)=C1

PubChem CID 459248
CAS 6318-56-5
Molecular Weight (g/mol) 161.59
MDL Number MFCD00662897
SMILES Cl.NC1=CC(O)=CC(O)=C1
Synonym 5-aminobenzene-1,3-diol hydrochloride,1,3-benzenediol, 5-amino-, hydrochloride,5-aminoresorcinol, hydrochloride,pubchem19962,5-aminobenzene-1,3-diol hcl,5-aminobenzene-1,3-diol hydrochloridyl
InChI Key VNZZCDQPCQIUGG-UHFFFAOYSA-N
Molecular Formula C6H8ClNO2
4

3,4-Dihydroxybenzylamine hydrobromide, 98%

CAS: 16290-26-9 Molecular Formula: C7H10BrNO2 Molecular Weight (g/mol): 220.07 MDL Number: MFCD00012859 InChI Key: BVFZTXFCZAXSHN-UHFFFAOYSA-N Synonym: 3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide PubChem CID: 13343562 IUPAC Name: 4-(aminomethyl)benzene-1,2-diol;hydrobromide SMILES: [H+].[Br-].NCC1=CC=C(O)C(O)=C1

PubChem CID 13343562
CAS 16290-26-9
Molecular Weight (g/mol) 220.07
MDL Number MFCD00012859
SMILES [H+].[Br-].NCC1=CC=C(O)C(O)=C1
Synonym 3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide
IUPAC Name 4-(aminomethyl)benzene-1,2-diol;hydrobromide
InChI Key BVFZTXFCZAXSHN-UHFFFAOYSA-N
Molecular Formula C7H10BrNO2
5

4-Bromoresorcinol, 98%

CAS: 6626-15-9 Molecular Formula: C6H5BrO2 Molecular Weight (g/mol): 189.01 MDL Number: MFCD00002272 InChI Key: MPCCNXGZCOXPMG-UHFFFAOYSA-N Synonym: 4-bromoresorcinol,1-bromo-2,4-dihydroxybenzene,1,3-benzenediol, 4-bromo,4-bromo-1,3-dihydroxybenzene,4-bromo-benzene-1,3-diol,4-bromo-resorcinol,resorcinol, 4-bromo,acmc-209nuf,2,4-dihydroxybromobenzene PubChem CID: 81105 IUPAC Name: 4-bromobenzene-1,3-diol SMILES: C1=CC(=C(C=C1O)O)Br

PubChem CID 81105
CAS 6626-15-9
Molecular Weight (g/mol) 189.01
MDL Number MFCD00002272
SMILES C1=CC(=C(C=C1O)O)Br
Synonym 4-bromoresorcinol,1-bromo-2,4-dihydroxybenzene,1,3-benzenediol, 4-bromo,4-bromo-1,3-dihydroxybenzene,4-bromo-benzene-1,3-diol,4-bromo-resorcinol,resorcinol, 4-bromo,acmc-209nuf,2,4-dihydroxybromobenzene
IUPAC Name 4-bromobenzene-1,3-diol
InChI Key MPCCNXGZCOXPMG-UHFFFAOYSA-N
Molecular Formula C6H5BrO2
6

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

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
7
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Orcinol Monohydrate, 99%

CAS: 6153-39-5 Molecular Formula: C7H8O2·H2O Molecular Weight (g/mol): 142.15 MDL Number: MFCD00149092 InChI Key: NBKPNAMTHBIMLA-UHFFFAOYSA-N Synonym: 5-methylbenzene-1,3-diol hydrate,orcinol monohydrate,5-methylresorcinol monohydrate,3,5-dihydroxytoluene monohydrate,orcinol hydrate,resorcinol, 5-methyl-, monohydrate,1,3-benzenediol, 5-methyl-, monohydrate,1,3-dihydroxy-5-methylbenzene monohydrate,acmc-209mtl,5-methylresorcinol hydrate PubChem CID: 3083941 IUPAC Name: 5-methylbenzene-1,3-diol;hydrate SMILES: CC1=CC(=CC(=C1)O)O.O

PubChem CID 3083941
CAS 6153-39-5
Molecular Weight (g/mol) 142.15
MDL Number MFCD00149092
SMILES CC1=CC(=CC(=C1)O)O.O
Synonym 5-methylbenzene-1,3-diol hydrate,orcinol monohydrate,5-methylresorcinol monohydrate,3,5-dihydroxytoluene monohydrate,orcinol hydrate,resorcinol, 5-methyl-, monohydrate,1,3-benzenediol, 5-methyl-, monohydrate,1,3-dihydroxy-5-methylbenzene monohydrate,acmc-209mtl,5-methylresorcinol hydrate
IUPAC Name 5-methylbenzene-1,3-diol;hydrate
InChI Key NBKPNAMTHBIMLA-UHFFFAOYSA-N
Molecular Formula C7H8O2·H2O
8

4-Chlororesorcinol, 98%

CAS: 95-88-5 Molecular Formula: C6H5ClO2 Molecular Weight (g/mol): 144.55 MDL Number: MFCD00002273 InChI Key: JQVAPEJNIZULEK-UHFFFAOYSA-N Synonym: 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene PubChem CID: 1731 IUPAC Name: 4-chlorobenzene-1,3-diol SMILES: OC1=CC=C(Cl)C(O)=C1

PubChem CID 1731
CAS 95-88-5
Molecular Weight (g/mol) 144.55
MDL Number MFCD00002273
SMILES OC1=CC=C(Cl)C(O)=C1
Synonym 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene
IUPAC Name 4-chlorobenzene-1,3-diol
InChI Key JQVAPEJNIZULEK-UHFFFAOYSA-N
Molecular Formula C6H5ClO2
9

2,3-Dimethylhydroquinone, 97%

CAS: 608-43-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00009997 InChI Key: BXJGUBZTZWCMEX-UHFFFAOYSA-N Synonym: 2,3-dimethylhydroquinone,o-xylene-3,6-diol,2,3-xylohydroquinone,o-xylohydroquinone,1,4-benzenediol, 2,3-dimethyl,unii-f0l7hg609j,1,4-dihydroxy-2,3-dimethylbenzene,3,6-dihydroxy-o-xylene,2,3-dimethyl-1,4-benzenediol,2,3-dimethyl hydroquinone PubChem CID: 69100 IUPAC Name: 2,3-dimethylbenzene-1,4-diol SMILES: CC1=C(C)C(O)=CC=C1O

PubChem CID 69100
CAS 608-43-5
Molecular Weight (g/mol) 138.17
MDL Number MFCD00009997
SMILES CC1=C(C)C(O)=CC=C1O
Synonym 2,3-dimethylhydroquinone,o-xylene-3,6-diol,2,3-xylohydroquinone,o-xylohydroquinone,1,4-benzenediol, 2,3-dimethyl,unii-f0l7hg609j,1,4-dihydroxy-2,3-dimethylbenzene,3,6-dihydroxy-o-xylene,2,3-dimethyl-1,4-benzenediol,2,3-dimethyl hydroquinone
IUPAC Name 2,3-dimethylbenzene-1,4-diol
InChI Key BXJGUBZTZWCMEX-UHFFFAOYSA-N
Molecular Formula C8H10O2
10
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Resorcinol, 98%

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 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) 110.11
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
11
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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
12

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

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
13
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o-Orsellinic acid hydrate, 98%

CAS: 480-64-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD16661187 InChI Key: AMKYESDOVDKZKV-UHFFFAOYSA-N Synonym: orsellinic acid,orsellic acid,o-orsellinic acid,orcinolcarboxylic acid,4,6-dihydroxy-o-toluic acid,unii-11xla0494b,benzoic acid, 2,4-dihydroxy-6-methyl,2,4-dihydroxy-6-methyl-benzoic acid,orsellinate,4,6-dihydroxy-2-methylbenzoic acid PubChem CID: 68072 ChEBI: CHEBI:32807 IUPAC Name: 2,4-dihydroxy-6-methylbenzoic acid SMILES: CC1=CC(O)=CC(O)=C1C(O)=O

PubChem CID 68072
CAS 480-64-8
Molecular Weight (g/mol) 168.15
ChEBI CHEBI:32807
MDL Number MFCD16661187
SMILES CC1=CC(O)=CC(O)=C1C(O)=O
Synonym orsellinic acid,orsellic acid,o-orsellinic acid,orcinolcarboxylic acid,4,6-dihydroxy-o-toluic acid,unii-11xla0494b,benzoic acid, 2,4-dihydroxy-6-methyl,2,4-dihydroxy-6-methyl-benzoic acid,orsellinate,4,6-dihydroxy-2-methylbenzoic acid
IUPAC Name 2,4-dihydroxy-6-methylbenzoic acid
InChI Key AMKYESDOVDKZKV-UHFFFAOYSA-N
Molecular Formula C8H8O4
14

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

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