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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (68,133)
Phenols (13,712)
Naphthalenes (5,120)
Fluorenes (1,235)
Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (419)
Tetralins (333)
Phenanthrenes and derivatives (332)
Indanes (313)
Triphenyl compounds (277)
Pyrenes (229)
Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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11,086 – 11,100 of 79,319 results
11,086

Phenethyl Caffeate 98.0+%, TCI America™

CAS: 104594-70-9 Molecular Formula: C17H16O4 Molecular Weight (g/mol): 284.31 MDL Number: MFCD00866470 InChI Key: SWUARLUWKZWEBQ-VQHVLOKHSA-N Synonym: caffeic acid phenethyl ester,phenethyl caffeate,cape,capeee,phenethyl 3-3,4-dihydroxyphenyl acrylate,phenylethyl caffeate,unii-g960r9s5sk,caffeic acid phenylethyl ester,2-phenylethyl caffeate,caffeic acid 2-phenylethyl ester PubChem CID: 5281787 ChEBI: CHEBI:8062 IUPAC Name: 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: OC1=CC=C(\C=C\C(=O)OCCC2=CC=CC=C2)C=C1O

PubChem CID 5281787
CAS 104594-70-9
Molecular Weight (g/mol) 284.31
ChEBI CHEBI:8062
MDL Number MFCD00866470
SMILES OC1=CC=C(\C=C\C(=O)OCCC2=CC=CC=C2)C=C1O
Synonym caffeic acid phenethyl ester,phenethyl caffeate,cape,capeee,phenethyl 3-3,4-dihydroxyphenyl acrylate,phenylethyl caffeate,unii-g960r9s5sk,caffeic acid phenylethyl ester,2-phenylethyl caffeate,caffeic acid 2-phenylethyl ester
IUPAC Name 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChI Key SWUARLUWKZWEBQ-VQHVLOKHSA-N
Molecular Formula C17H16O4
11,087

3,5-Dihydroxybenzyl Alcohol 97.0+%, TCI America™

CAS: 29654-55-5 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.138 MDL Number: MFCD00016867 InChI Key: NGYYFWGABVVEPL-UHFFFAOYSA-N Synonym: 3,5-dihydroxybenzyl alcohol,5-hydroxymethyl-1,3-benzenediol,5-hydroxymethyl benzene-1,3-diol,5-hydroxymethyl resorcinol,benzyl alcohol, 3,5-dihydroxy,1,3-benzenediol, 5-hydroxymethyl,3,5-dihydroxybenzylalcohol,3,5-dihydroxy benzyl alcohol,pubchem7418,acmc-1cjog PubChem CID: 34661 IUPAC Name: 5-(hydroxymethyl)benzene-1,3-diol SMILES: C1=C(C=C(C=C1O)O)CO

PubChem CID 34661
CAS 29654-55-5
Molecular Weight (g/mol) 140.138
MDL Number MFCD00016867
SMILES C1=C(C=C(C=C1O)O)CO
Synonym 3,5-dihydroxybenzyl alcohol,5-hydroxymethyl-1,3-benzenediol,5-hydroxymethyl benzene-1,3-diol,5-hydroxymethyl resorcinol,benzyl alcohol, 3,5-dihydroxy,1,3-benzenediol, 5-hydroxymethyl,3,5-dihydroxybenzylalcohol,3,5-dihydroxy benzyl alcohol,pubchem7418,acmc-1cjog
IUPAC Name 5-(hydroxymethyl)benzene-1,3-diol
InChI Key NGYYFWGABVVEPL-UHFFFAOYSA-N
Molecular Formula C7H8O3
11,088

Resorcinol 99.0+%, TCI America™

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: 1,3-Dihydroxybenzene 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 1,3-Dihydroxybenzene
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
11,089

2-Methylresorcinol 98.0+%, TCI America™

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
11,090

4-Fluorocatechol 98.0+%, TCI America™

CAS: 367-32-8 Molecular Formula: C6H5FO2 Molecular Weight (g/mol): 128.102 MDL Number: MFCD01317539 InChI Key: NFWGQJUHSAGJBE-UHFFFAOYSA-N Synonym: 4-Fluoro-1,2-dihydroxybenzene, 4-Fluoropyrocatechol PubChem CID: 160458 ChEBI: CHEBI:80515 IUPAC Name: 4-fluorobenzene-1,2-diol SMILES: C1=CC(=C(C=C1F)O)O

PubChem CID 160458
CAS 367-32-8
Molecular Weight (g/mol) 128.102
ChEBI CHEBI:80515
MDL Number MFCD01317539
SMILES C1=CC(=C(C=C1F)O)O
Synonym 4-Fluoro-1,2-dihydroxybenzene, 4-Fluoropyrocatechol
IUPAC Name 4-fluorobenzene-1,2-diol
InChI Key NFWGQJUHSAGJBE-UHFFFAOYSA-N
Molecular Formula C6H5FO2
11,091

4-Nitrocatechol 98.0+%, TCI America™

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
11,092

2,3-Dimethylhydroquinone 98.0+%, TCI America™

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
11,093

2,5-Dihydroxybenzoic Acid Butylamine Salt 98.0+%, TCI America™

CAS: 666174-80-7 Molecular Formula: C11H17NO4 Molecular Weight (g/mol): 227.26 InChI Key: OGLUKKYDTRVMHP-UHFFFAOYSA-N Synonym: Butylammonium 2,5-Dihydroxybenzoate, DHBB, DHB/B PubChem CID: 69807822 IUPAC Name: butan-1-amine;2,5-dihydroxybenzoic acid SMILES: CCCCN.C1=CC(=C(C=C1O)C(=O)O)O

PubChem CID 69807822
CAS 666174-80-7
Molecular Weight (g/mol) 227.26
SMILES CCCCN.C1=CC(=C(C=C1O)C(=O)O)O
Synonym Butylammonium 2,5-Dihydroxybenzoate, DHBB, DHB/B
IUPAC Name butan-1-amine;2,5-dihydroxybenzoic acid
InChI Key OGLUKKYDTRVMHP-UHFFFAOYSA-N
Molecular Formula C11H17NO4
11,094

4-Methylcatechol 98.0+%, TCI America™

CAS: 452-86-8 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00002205 InChI Key: ZBCATMYQYDCTIZ-UHFFFAOYSA-N Synonym: 4-methylcatechol,3,4-dihydroxytoluene,homocatechol,4-methyl-1,2-benzenediol,p-methylcatechol,4-methylpyrocatechol,homopyrocatechol,1,2-dihydroxy-4-methylbenzene,p-methylpyrocatechol,toluene-3,4-diol PubChem CID: 9958 ChEBI: CHEBI:17254 IUPAC Name: 4-methylbenzene-1,2-diol SMILES: CC1=CC=C(O)C(O)=C1

PubChem CID 9958
CAS 452-86-8
Molecular Weight (g/mol) 124.14
ChEBI CHEBI:17254
MDL Number MFCD00002205
SMILES CC1=CC=C(O)C(O)=C1
Synonym 4-methylcatechol,3,4-dihydroxytoluene,homocatechol,4-methyl-1,2-benzenediol,p-methylcatechol,4-methylpyrocatechol,homopyrocatechol,1,2-dihydroxy-4-methylbenzene,p-methylpyrocatechol,toluene-3,4-diol
IUPAC Name 4-methylbenzene-1,2-diol
InChI Key ZBCATMYQYDCTIZ-UHFFFAOYSA-N
Molecular Formula C7H8O2
11,095

Phenylhydroquinone 98.0+%, TCI America™

CAS: 1079-21-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00002342 InChI Key: XCZKKZXWDBOGPA-UHFFFAOYSA-N Synonym: phenylhydroquinone,2-phenylhydroquinone,2,5-dihydroxybiphenyl,1,1'-biphenyl-2,5-diol,biphenyl-2,5-diol,hydroquinone, phenyl,1,4-benzenediol, phenyl,2,5-biphenyldiol,o-phenylhydroquinone PubChem CID: 14116 IUPAC Name: [1,1'-biphenyl]-2,5-diol SMILES: OC1=CC=C(O)C(=C1)C1=CC=CC=C1

PubChem CID 14116
CAS 1079-21-6
Molecular Weight (g/mol) 186.21
MDL Number MFCD00002342
SMILES OC1=CC=C(O)C(=C1)C1=CC=CC=C1
Synonym phenylhydroquinone,2-phenylhydroquinone,2,5-dihydroxybiphenyl,1,1'-biphenyl-2,5-diol,biphenyl-2,5-diol,hydroquinone, phenyl,1,4-benzenediol, phenyl,2,5-biphenyldiol,o-phenylhydroquinone
IUPAC Name [1,1'-biphenyl]-2,5-diol
InChI Key XCZKKZXWDBOGPA-UHFFFAOYSA-N
Molecular Formula C12H10O2
11,096

Trimethylhydroquinone 98.0+%, TCI America™

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
11,097

Catechol 99.0+%, TCI America™

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
11,098

Isorhapontigenin 96.0+%, TCI America™

CAS: 32507-66-7 Molecular Formula: C15H14O4 Molecular Weight (g/mol): 258.273 MDL Number: MFCD12407151 InChI Key: ANNNBEZJTNCXHY-NSCUHMNNSA-N Synonym: 3,4′C,5-Trihydroxy-3′C-methoxy-trans-stilbene PubChem CID: 5318650 IUPAC Name: 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol SMILES: COC1=C(C=CC(=C1)C=CC2=CC(=CC(=C2)O)O)O

PubChem CID 5318650
CAS 32507-66-7
Molecular Weight (g/mol) 258.273
MDL Number MFCD12407151
SMILES COC1=C(C=CC(=C1)C=CC2=CC(=CC(=C2)O)O)O
Synonym 3,4′C,5-Trihydroxy-3′C-methoxy-trans-stilbene
IUPAC Name 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol
InChI Key ANNNBEZJTNCXHY-NSCUHMNNSA-N
Molecular Formula C15H14O4
11,099

Homogentisic Acid 97.0+%, TCI America™

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
11,100

DL-Adrenaline Hydrochloride 98.0+%, TCI America™

CAS: 329-63-5 Molecular Formula: C9H14ClNO3 Molecular Weight (g/mol): 219.665 MDL Number: MFCD00050562 InChI Key: ATADHKWKHYVBTJ-UHFFFAOYSA-N Synonym: DL-Epinephrine Hydrochloride PubChem CID: 5924 IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol;hydrochloride SMILES: CNCC(C1=CC(=C(C=C1)O)O)O.Cl

PubChem CID 5924
CAS 329-63-5
Molecular Weight (g/mol) 219.665
MDL Number MFCD00050562
SMILES CNCC(C1=CC(=C(C=C1)O)O)O.Cl
Synonym DL-Epinephrine Hydrochloride
IUPAC Name 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol;hydrochloride
InChI Key ATADHKWKHYVBTJ-UHFFFAOYSA-N
Molecular Formula C9H14ClNO3