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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 174 results
1

Thermo Scientific™ Piceatannol

CAS: 10083-24-6 Molecular Formula: C14H12O4 Molecular Weight (g/mol): 244.25 InChI Key: CDRPUGZCRXZLFL-OWOJBTEDSA-N IUPAC Name: 5-[(1E)-2-(3,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol SMILES: OC1=CC(\C=C\C2=CC=C(O)C(O)=C2)=CC(O)=C1

CAS 10083-24-6
Molecular Weight (g/mol) 244.25
SMILES OC1=CC(\C=C\C2=CC=C(O)C(O)=C2)=CC(O)=C1
IUPAC Name 5-[(1E)-2-(3,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol
InChI Key CDRPUGZCRXZLFL-OWOJBTEDSA-N
Molecular Formula C14H12O4
2

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
3

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

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
4

3,5-Dihydroxybenzoic acid, 97%

CAS: 99-10-5 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002512 InChI Key: UYEMGAFJOZZIFP-UHFFFAOYSA-N Synonym: alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid PubChem CID: 7424 ChEBI: CHEBI:39912 IUPAC Name: 3,5-dihydroxybenzoic acid SMILES: OC(=O)C1=CC(O)=CC(O)=C1

PubChem CID 7424
CAS 99-10-5
Molecular Weight (g/mol) 154.12
ChEBI CHEBI:39912
MDL Number MFCD00002512
SMILES OC(=O)C1=CC(O)=CC(O)=C1
Synonym alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid
IUPAC Name 3,5-dihydroxybenzoic acid
InChI Key UYEMGAFJOZZIFP-UHFFFAOYSA-N
Molecular Formula C7H6O4
5

3-Methylcatechol, 97%

CAS: 488-17-5 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00016435 InChI Key: PGSWEKYNAOWQDF-UHFFFAOYSA-N Synonym: 3-methylcatechol,2,3-dihydroxytoluene,3-methylpyrocatechol,1,2-benzenediol, 3-methyl,2,3-toluenediol,dihydroxytoluene,pyrocatechol, 3-methyl,catechol, 3-methyl,1,2-dihydroxy-3-methylbenzene,3-methyl-1,2-benzenediol PubChem CID: 340 ChEBI: CHEBI:18404 IUPAC Name: 3-methylbenzene-1,2-diol SMILES: CC1=C(C(=CC=C1)O)O

PubChem CID 340
CAS 488-17-5
Molecular Weight (g/mol) 124.139
ChEBI CHEBI:18404
MDL Number MFCD00016435
SMILES CC1=C(C(=CC=C1)O)O
Synonym 3-methylcatechol,2,3-dihydroxytoluene,3-methylpyrocatechol,1,2-benzenediol, 3-methyl,2,3-toluenediol,dihydroxytoluene,pyrocatechol, 3-methyl,catechol, 3-methyl,1,2-dihydroxy-3-methylbenzene,3-methyl-1,2-benzenediol
IUPAC Name 3-methylbenzene-1,2-diol
InChI Key PGSWEKYNAOWQDF-UHFFFAOYSA-N
Molecular Formula C7H8O2
6

2,4,6-Tribromoresorcinol, 98%

CAS: 2437-49-2 Molecular Formula: C6H3Br3O2 Molecular Weight (g/mol): 346.8 MDL Number: MFCD00009717 InChI Key: YADZSMVDNYXOOB-UHFFFAOYSA-N Synonym: 2,4,6-tribromoresorcinol,resorcinol, 2,4,6-tribromo,1,3-benzenediol, 2,4,6-tribromo,2,6-tribromoresorcinol,acmc-209gbn,2,4,6-tribromresorcin,2,4,6-tribromoresorcino,resorcinol,4,6-tribromo,1, 2,4,6-tribromo,4-06-00-05688 beilstein handbook reference PubChem CID: 17094 IUPAC Name: 2,4,6-tribromobenzene-1,3-diol SMILES: C1=C(C(=C(C(=C1Br)O)Br)O)Br

PubChem CID 17094
CAS 2437-49-2
Molecular Weight (g/mol) 346.8
MDL Number MFCD00009717
SMILES C1=C(C(=C(C(=C1Br)O)Br)O)Br
Synonym 2,4,6-tribromoresorcinol,resorcinol, 2,4,6-tribromo,1,3-benzenediol, 2,4,6-tribromo,2,6-tribromoresorcinol,acmc-209gbn,2,4,6-tribromresorcin,2,4,6-tribromoresorcino,resorcinol,4,6-tribromo,1, 2,4,6-tribromo,4-06-00-05688 beilstein handbook reference
IUPAC Name 2,4,6-tribromobenzene-1,3-diol
InChI Key YADZSMVDNYXOOB-UHFFFAOYSA-N
Molecular Formula C6H3Br3O2
7

2,5-Dihydroxyphenylacetic acid, 97%, Thermo Scientific™

CAS: 451-13-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00004324 InChI Key: IGMNYECMUMZDDF-UHFFFAOYSA-N Synonym: homogentisic acid,2,5-dihydroxyphenylacetic acid,alcapton,homogentisate acid,homogentisinic acid,2,5-dihydroxyphenyl acetic acid,homogentisate,benzeneacetic acid, 2,5-dihydroxy,2-2,5-dihydroxyphenyl acetic acid,2,5-dihydroxy-alpha-toluic acid PubChem CID: 780 ChEBI: CHEBI:44747 IUPAC Name: 2-(2,5-dihydroxyphenyl)acetic acid SMILES: OC(=O)CC1=CC(O)=CC=C1O

PubChem CID 780
CAS 451-13-8
Molecular Weight (g/mol) 168.15
ChEBI CHEBI:44747
MDL Number MFCD00004324
SMILES OC(=O)CC1=CC(O)=CC=C1O
Synonym homogentisic acid,2,5-dihydroxyphenylacetic acid,alcapton,homogentisate acid,homogentisinic acid,2,5-dihydroxyphenyl acetic acid,homogentisate,benzeneacetic acid, 2,5-dihydroxy,2-2,5-dihydroxyphenyl acetic acid,2,5-dihydroxy-alpha-toluic acid
IUPAC Name 2-(2,5-dihydroxyphenyl)acetic acid
InChI Key IGMNYECMUMZDDF-UHFFFAOYSA-N
Molecular Formula C8H8O4
8

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

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
9

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

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
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

4-Bromo-3,5-dihydroxybenzoic acid, 97+%

CAS: 16534-12-6 Molecular Formula: C7H5BrO4 Molecular Weight (g/mol): 233.017 MDL Number: MFCD00002513 InChI Key: NUTRHYYFCDEALP-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-3,5-dihydroxy,4-bromo-3,5-resorcylic acid,4-bromo-alpha-resorcylic acid,4-bromo-3,5-dihydroxybenzic acid,.alpha.-resorcylic acid, 4-bromo,4-bromo-3,5-dihydroxy-benzoic acid,alpha-resorcylic acid, 4-bromo,pubchem8196,acmc-209dsh,ksc177s3r PubChem CID: 86023 IUPAC Name: 4-bromo-3,5-dihydroxybenzoic acid SMILES: C1=C(C=C(C(=C1O)Br)O)C(=O)O

PubChem CID 86023
CAS 16534-12-6
Molecular Weight (g/mol) 233.017
MDL Number MFCD00002513
SMILES C1=C(C=C(C(=C1O)Br)O)C(=O)O
Synonym benzoic acid, 4-bromo-3,5-dihydroxy,4-bromo-3,5-resorcylic acid,4-bromo-alpha-resorcylic acid,4-bromo-3,5-dihydroxybenzic acid,.alpha.-resorcylic acid, 4-bromo,4-bromo-3,5-dihydroxy-benzoic acid,alpha-resorcylic acid, 4-bromo,pubchem8196,acmc-209dsh,ksc177s3r
IUPAC Name 4-bromo-3,5-dihydroxybenzoic acid
InChI Key NUTRHYYFCDEALP-UHFFFAOYSA-N
Molecular Formula C7H5BrO4
12

DL-Isoproterenol hydrochloride, 98%

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: hydrogen 4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,2-diol chloride 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 hydrogen 4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,2-diol chloride
InChI Key IROWCYIEJAOFOW-UHFFFAOYNA-N
Molecular Formula C11H18ClNO3
13

DL-Adrenaline

CAS: 329-65-7 Molecular Formula: C9H13NO3 Molecular Weight (g/mol): 183.207 MDL Number: MFCD00063027 InChI Key: UCTWMZQNUQWSLP-UHFFFAOYSA-N Synonym: dl-adrenaline,racepinephrine,racepinefrine,dl-epinephrine,+--adrenaline,epinephrine racemic,racepinefrina,racepinefrinum,+--epinephrine,4-1-hydroxy-2-methylamino ethyl benzene-1,2-diol PubChem CID: 838 ChEBI: CHEBI:33568 IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol SMILES: CNCC(C1=CC(=C(C=C1)O)O)O

PubChem CID 838
CAS 329-65-7
Molecular Weight (g/mol) 183.207
ChEBI CHEBI:33568
MDL Number MFCD00063027
SMILES CNCC(C1=CC(=C(C=C1)O)O)O
Synonym dl-adrenaline,racepinephrine,racepinefrine,dl-epinephrine,+--adrenaline,epinephrine racemic,racepinefrina,racepinefrinum,+--epinephrine,4-1-hydroxy-2-methylamino ethyl benzene-1,2-diol
IUPAC Name 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
InChI Key UCTWMZQNUQWSLP-UHFFFAOYSA-N
Molecular Formula C9H13NO3
14

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
15

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