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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 39 results
1

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

EDGE
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
2

Hydroquinone, 99%

CAS: 123-31-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 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

PubChem CID 785
CAS 123-31-9
Molecular Weight (g/mol) 110.11
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
3

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
4

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

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
5

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
6

Orcinol, 98%

CAS: 504-15-4 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00002291 InChI Key: OIPPWFOQEKKFEE-UHFFFAOYSA-N Synonym: orcinol,3,5-dihydroxytoluene,5-methylresorcinol,1,3-dihydroxy-5-methylbenzene,orcin,5-methyl-1,3-benzenediol,5-methylresorcin,3-hydroxy-5-methylphenol,3,5-toluenediol,1,3-benzenediol, 5-methyl PubChem CID: 10436 ChEBI: CHEBI:16536 IUPAC Name: 5-methylbenzene-1,3-diol SMILES: CC1=CC(O)=CC(O)=C1

PubChem CID 10436
CAS 504-15-4
Molecular Weight (g/mol) 124.14
ChEBI CHEBI:16536
MDL Number MFCD00002291
SMILES CC1=CC(O)=CC(O)=C1
Synonym orcinol,3,5-dihydroxytoluene,5-methylresorcinol,1,3-dihydroxy-5-methylbenzene,orcin,5-methyl-1,3-benzenediol,5-methylresorcin,3-hydroxy-5-methylphenol,3,5-toluenediol,1,3-benzenediol, 5-methyl
IUPAC Name 5-methylbenzene-1,3-diol
InChI Key OIPPWFOQEKKFEE-UHFFFAOYSA-N
Molecular Formula C7H8O2
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

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

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
9

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

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
10

Quinhydrone, 98%

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
11

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
12

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

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
13

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
14

4-Nitrocatechol, 97%

CAS: 3316-09-4 Molecular Formula: C6H5NO4 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00007242 InChI Key: XJNPNXSISMKQEX-UHFFFAOYSA-N Synonym: 4-nitrocatechol,4-nitropyrocatechol,1,2-dihydroxy-4-nitrobenzene,4-nitro-1,2-benzenediol,3,4-dihydroxy-1-nitrobenzene,unii-sw60ng75en,sw60ng75en,1,2-benzenediol, 4-nitro,nitrocatechol mix of isomers,4nc PubChem CID: 3505109 ChEBI: CHEBI:16318 IUPAC Name: 4-nitrobenzene-1,2-diol SMILES: C1=CC(=C(C=C1[N+](=O)[O-])O)O

PubChem CID 3505109
CAS 3316-09-4
Molecular Weight (g/mol) 155.11
ChEBI CHEBI:16318
MDL Number MFCD00007242
SMILES C1=CC(=C(C=C1[N+](=O)[O-])O)O
Synonym 4-nitrocatechol,4-nitropyrocatechol,1,2-dihydroxy-4-nitrobenzene,4-nitro-1,2-benzenediol,3,4-dihydroxy-1-nitrobenzene,unii-sw60ng75en,sw60ng75en,1,2-benzenediol, 4-nitro,nitrocatechol mix of isomers,4nc
IUPAC Name 4-nitrobenzene-1,2-diol
InChI Key XJNPNXSISMKQEX-UHFFFAOYSA-N
Molecular Formula C6H5NO4
15

3,4-Dihydroxyphenylacetic acid, 98%

CAS: 102-32-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 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) 168.15
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