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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 (130,195)
Phenols (25,097)
Naphthalenes (6,365)
Phenol esters (4,813)
Unsubstituted Phenols (1,453)
Fluorenes (1,295)
Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (337)
Triphenyl compounds (278)
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Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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7,021 – 7,035 of 159,118 results
7,021

Quinhydrone, TCI America™

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
7,022

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
7,023

3-Bromocatechol 98.0+%, TCI America™

CAS: 14381-51-2 Molecular Formula: C6H5BrO2 Molecular Weight (g/mol): 189.008 MDL Number: MFCD00869768 InChI Key: JPBDMIWPTFDFEU-UHFFFAOYSA-N Synonym: 3-bromocatechol,3-bromopyrocatechol,1-bromo-2,3-dihydroxybenzene,1,2-benzenediol, 3-bromo,benzenediol, bromo,3-bromo-1,2-benzenediol,2,3-dihydroxy-bromobenzene,bromocatechol,3-bromoatechol,pubchem19085 PubChem CID: 26659 IUPAC Name: 3-bromobenzene-1,2-diol SMILES: C1=CC(=C(C(=C1)Br)O)O

PubChem CID 26659
CAS 14381-51-2
Molecular Weight (g/mol) 189.008
MDL Number MFCD00869768
SMILES C1=CC(=C(C(=C1)Br)O)O
Synonym 3-bromocatechol,3-bromopyrocatechol,1-bromo-2,3-dihydroxybenzene,1,2-benzenediol, 3-bromo,benzenediol, bromo,3-bromo-1,2-benzenediol,2,3-dihydroxy-bromobenzene,bromocatechol,3-bromoatechol,pubchem19085
IUPAC Name 3-bromobenzene-1,2-diol
InChI Key JPBDMIWPTFDFEU-UHFFFAOYSA-N
Molecular Formula C6H5BrO2
7,024

3-Methoxycatechol 98.0+%, TCI America™

CAS: 934-00-9 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.138 MDL Number: MFCD00002191 InChI Key: LPYUENQFPVNPHY-UHFFFAOYSA-N Synonym: 3-methoxycatechol,1,2-benzenediol, 3-methoxy,3-methoxypyrocatechol,pyrocatechol, 3-methoxy,2,3-dihydroxyanisole,pyrogallol 1-methyl ether,1,2-dihydroxy-3-methoxybenzene,6-methoxycatechol,pyrogallol 1-monomethyl ether,3-methoxy-1,2-benzenediol PubChem CID: 13622 IUPAC Name: 3-methoxybenzene-1,2-diol SMILES: COC1=CC=CC(=C1O)O

PubChem CID 13622
CAS 934-00-9
Molecular Weight (g/mol) 140.138
MDL Number MFCD00002191
SMILES COC1=CC=CC(=C1O)O
Synonym 3-methoxycatechol,1,2-benzenediol, 3-methoxy,3-methoxypyrocatechol,pyrocatechol, 3-methoxy,2,3-dihydroxyanisole,pyrogallol 1-methyl ether,1,2-dihydroxy-3-methoxybenzene,6-methoxycatechol,pyrogallol 1-monomethyl ether,3-methoxy-1,2-benzenediol
IUPAC Name 3-methoxybenzene-1,2-diol
InChI Key LPYUENQFPVNPHY-UHFFFAOYSA-N
Molecular Formula C7H8O3
7,025

5-Methylresorcinol Monohydrate 98.0+%, TCI America™

CAS: 6153-39-5 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 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) 142.154
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 C7H10O3
7,026

3,5-Dihydroxy-4-methylbenzoic Acid 98.0+%, TCI America™

CAS: 28026-96-2 Molecular Formula: C8H7O4 Molecular Weight (g/mol): 167.14 MDL Number: MFCD00002514 InChI Key: KMRRXSZDSGYLCD-UHFFFAOYSA-M Synonym: 3,5-dihydroxy-p-toluic acid,benzoic acid, 3,5-dihydroxy-4-methyl,4-methyl-3,5-dihydroxy benzoic acid,3,5-dihydroxy-4-methyl-benzoic acid,pubchem3868,acmc-20a50j,paragos 440034,3,5-dihydroxy4-methylbenzoic acid,3,5-dihydroxy-4-methyl benzoic acid,benzoic acid,3,5-dihydroxy-4-methyl PubChem CID: 2748045 IUPAC Name: 3,5-dihydroxy-4-methylbenzoate SMILES: CC1=C(O)C=C(C=C1O)C([O-])=O

PubChem CID 2748045
CAS 28026-96-2
Molecular Weight (g/mol) 167.14
MDL Number MFCD00002514
SMILES CC1=C(O)C=C(C=C1O)C([O-])=O
Synonym 3,5-dihydroxy-p-toluic acid,benzoic acid, 3,5-dihydroxy-4-methyl,4-methyl-3,5-dihydroxy benzoic acid,3,5-dihydroxy-4-methyl-benzoic acid,pubchem3868,acmc-20a50j,paragos 440034,3,5-dihydroxy4-methylbenzoic acid,3,5-dihydroxy-4-methyl benzoic acid,benzoic acid,3,5-dihydroxy-4-methyl
IUPAC Name 3,5-dihydroxy-4-methylbenzoate
InChI Key KMRRXSZDSGYLCD-UHFFFAOYSA-M
Molecular Formula C8H7O4
7,027

2',4'-Dihydroxy-2-(4-methoxyphenyl)acetophenone 98.0+%, TCI America™

CAS: 487-49-0 Molecular Formula: C15H14O4 Molecular Weight (g/mol): 258.273 MDL Number: MFCD00020119 InChI Key: XHBZOAYMBBUURD-UHFFFAOYSA-N Synonym: ononetin,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl ethanone,2',4'-dihydroxy-2-4-methoxyphenyl acetophenone,acetophenone, 2',4'-dihydroxy-2-p-methoxyphenyl,2,4-dihydroxy-4'-methoxydeoxybenzoin,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl-ethanone,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl ethan-1-one,spectrum_000796,spectrum2_000808,spectrum3_001777 PubChem CID: 259632 IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O

PubChem CID 259632
CAS 487-49-0
Molecular Weight (g/mol) 258.273
MDL Number MFCD00020119
SMILES COC1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O
Synonym ononetin,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl ethanone,2',4'-dihydroxy-2-4-methoxyphenyl acetophenone,acetophenone, 2',4'-dihydroxy-2-p-methoxyphenyl,2,4-dihydroxy-4'-methoxydeoxybenzoin,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl-ethanone,1-2,4-dihydroxyphenyl-2-4-methoxyphenyl ethan-1-one,spectrum_000796,spectrum2_000808,spectrum3_001777
IUPAC Name 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone
InChI Key XHBZOAYMBBUURD-UHFFFAOYSA-N
Molecular Formula C15H14O4
7,028

4,6-Diaminoresorcinol Dihydrochloride 98.0+%, TCI America™

CAS: 16523-31-2 Molecular Formula: C6H10Cl2N2O2 Molecular Weight (g/mol): 213.058 MDL Number: MFCD00143239 InChI Key: KUMOYHHELWKOCB-UHFFFAOYSA-N Synonym: 4,6-diaminoresorcinol dihydrochloride,4,6-diaminobenzene-1,3-diol dihydrochloride,4,6-diaminoresorcinol 2hcl,1,3-benzenediol, 4,6-diamino-, dihydrochloride,4,6-diamino resorcinol dihydrochloride,4,6-diamino-benzene-1,3-diol 2hcl salt,1,3-benzenediol, 4,6-diamino-, hydrochloride 1:2,4,6-bis azanyl benzene-1,3-diol dihydrochloride,pubchem20873,acmc-1c78d PubChem CID: 2733648 IUPAC Name: 4,6-diaminobenzene-1,3-diol;dihydrochloride SMILES: C1=C(C(=CC(=C1N)O)O)N.Cl.Cl

PubChem CID 2733648
CAS 16523-31-2
Molecular Weight (g/mol) 213.058
MDL Number MFCD00143239
SMILES C1=C(C(=CC(=C1N)O)O)N.Cl.Cl
Synonym 4,6-diaminoresorcinol dihydrochloride,4,6-diaminobenzene-1,3-diol dihydrochloride,4,6-diaminoresorcinol 2hcl,1,3-benzenediol, 4,6-diamino-, dihydrochloride,4,6-diamino resorcinol dihydrochloride,4,6-diamino-benzene-1,3-diol 2hcl salt,1,3-benzenediol, 4,6-diamino-, hydrochloride 1:2,4,6-bis azanyl benzene-1,3-diol dihydrochloride,pubchem20873,acmc-1c78d
IUPAC Name 4,6-diaminobenzene-1,3-diol;dihydrochloride
InChI Key KUMOYHHELWKOCB-UHFFFAOYSA-N
Molecular Formula C6H10Cl2N2O2
7,029

Fullerene C60 (pure) 99.5+%, TCI America™

CAS: 99685-96-8 Molecular Formula: C60 Molecular Weight (g/mol): 720.66 MDL Number: MFCD00151408 InChI Key: XMWRBQBLMFGWIX-UHFFFAOYSA-N Synonym: fullerene,buckminsterfullerene,buckyball,fullerene 60,60 fullerene,footballene,fullerene-c60,5,6 fullerene-c60-ih PubChem CID: 123591 ChEBI: CHEBI:33128 IUPAC Name: (C60-Ih)[5,6]fullerene SMILES: C12=C3C4=C5C1=C1C6=C7C2=C2C8=C3C3=C9C4=C4C%10=C5C5=C1C1=C6C6=C%11C7=C2C2=C7C8=C3C3=C8C9=C4C4=C9C%10=C5C5=C1C1=C6C6=C%11C2=C2C7=C3C3=C8C4=C4C9=C5C1=C1C6=C2C3=C41

PubChem CID 123591
CAS 99685-96-8
Molecular Weight (g/mol) 720.66
ChEBI CHEBI:33128
MDL Number MFCD00151408
SMILES C12=C3C4=C5C1=C1C6=C7C2=C2C8=C3C3=C9C4=C4C%10=C5C5=C1C1=C6C6=C%11C7=C2C2=C7C8=C3C3=C8C9=C4C4=C9C%10=C5C5=C1C1=C6C6=C%11C2=C2C7=C3C3=C8C4=C4C9=C5C1=C1C6=C2C3=C41
Synonym fullerene,buckminsterfullerene,buckyball,fullerene 60,60 fullerene,footballene,fullerene-c60,5,6 fullerene-c60-ih
IUPAC Name (C60-Ih)[5,6]fullerene
InChI Key XMWRBQBLMFGWIX-UHFFFAOYSA-N
Molecular Formula C60
7,030

4-Chlorophenyl Methyl Sulfone 98.0+%, TCI America™

CAS: 98-57-7 Molecular Formula: C7H7ClO2S Molecular Weight (g/mol): 190.641 MDL Number: MFCD00025067 InChI Key: LMCOQDVJBWVNNI-UHFFFAOYSA-N Synonym: 4-chlorophenyl methyl sulfone,1-chloro-4-methylsulfonyl benzene,p-chlorophenyl methyl sulfone,4-methylsulfuryl chlorobenzene,benzene, 1-chloro-4-methylsulfonyl,methyl 4-chlorophenyl sulfone,sulfone, p-chlorophenyl methyl,1-chloro-4-methylsulphonyl benzene,4-chlorophenylmethyl sulfone,methyl p-chlorophenyl sulfone PubChem CID: 7395 IUPAC Name: 1-chloro-4-methylsulfonylbenzene SMILES: CS(=O)(=O)C1=CC=C(C=C1)Cl

PubChem CID 7395
CAS 98-57-7
Molecular Weight (g/mol) 190.641
MDL Number MFCD00025067
SMILES CS(=O)(=O)C1=CC=C(C=C1)Cl
Synonym 4-chlorophenyl methyl sulfone,1-chloro-4-methylsulfonyl benzene,p-chlorophenyl methyl sulfone,4-methylsulfuryl chlorobenzene,benzene, 1-chloro-4-methylsulfonyl,methyl 4-chlorophenyl sulfone,sulfone, p-chlorophenyl methyl,1-chloro-4-methylsulphonyl benzene,4-chlorophenylmethyl sulfone,methyl p-chlorophenyl sulfone
IUPAC Name 1-chloro-4-methylsulfonylbenzene
InChI Key LMCOQDVJBWVNNI-UHFFFAOYSA-N
Molecular Formula C7H7ClO2S
7,031

2-(3-Bromophenyl)triphenylene 98.0+%, TCI America™

CAS: 1313514-53-2 Molecular Formula: C24H15Br Molecular Weight (g/mol): 383.288 InChI Key: KWXFBIBEVROWEF-UHFFFAOYSA-N PubChem CID: 58472032 IUPAC Name: 2-(3-bromophenyl)triphenylene SMILES: C1=CC=C2C(=C1)C3=C(C=C(C=C3)C4=CC(=CC=C4)Br)C5=CC=CC=C25

PubChem CID 58472032
CAS 1313514-53-2
Molecular Weight (g/mol) 383.288
SMILES C1=CC=C2C(=C1)C3=C(C=C(C=C3)C4=CC(=CC=C4)Br)C5=CC=CC=C25
IUPAC Name 2-(3-bromophenyl)triphenylene
InChI Key KWXFBIBEVROWEF-UHFFFAOYSA-N
Molecular Formula C24H15Br
7,032

Coronene 83.0+%, TCI America™

CAS: 191-07-1 Molecular Formula: C24H12 Molecular Weight (g/mol): 300.36 MDL Number: MFCD00004134 InChI Key: VPUGDVKSAQVFFS-UHFFFAOYSA-N Synonym: hexabenzobenzene,dibenzo ghi,pqr perylene,superbenzene,unii-7yy0x5xt1w,ccris 908,7yy0x5xt1w,6 circulene,coronene,acmc-209eul PubChem CID: 9115 ChEBI: CHEBI:29863 IUPAC Name: coronene SMILES: C1=CC2=CC=C3C=CC4=CC=C5C=CC6=CC=C1C1=C2C3=C4C5=C61

PubChem CID 9115
CAS 191-07-1
Molecular Weight (g/mol) 300.36
ChEBI CHEBI:29863
MDL Number MFCD00004134
SMILES C1=CC2=CC=C3C=CC4=CC=C5C=CC6=CC=C1C1=C2C3=C4C5=C61
Synonym hexabenzobenzene,dibenzo ghi,pqr perylene,superbenzene,unii-7yy0x5xt1w,ccris 908,7yy0x5xt1w,6 circulene,coronene,acmc-209eul
IUPAC Name coronene
InChI Key VPUGDVKSAQVFFS-UHFFFAOYSA-N
Molecular Formula C24H12
7,033

[6,6]-Phenyl-C61-butyric Acid Butyl Ester 98.0+%, TCI America™

CAS: 571177-66-7 Molecular Formula: C75H20O2 MDL Number: MFCD09842755 Synonym: PCBB, [60]PCB-C4

CAS 571177-66-7
MDL Number MFCD09842755
Synonym PCBB, [60]PCB-C4
Molecular Formula C75H20O2
7,034

Triphenylene (purified by sublimation) 98.0+%, TCI America™

CAS: 217-59-4 Molecular Formula: C18H12 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00001108 InChI Key: SLGBZMMZGDRARJ-UHFFFAOYSA-N Synonym: 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl PubChem CID: 9170 ChEBI: CHEBI:33080 IUPAC Name: triphenylene SMILES: C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21

PubChem CID 9170
CAS 217-59-4
Molecular Weight (g/mol) 228.29
ChEBI CHEBI:33080
MDL Number MFCD00001108
SMILES C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21
Synonym 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl
IUPAC Name triphenylene
InChI Key SLGBZMMZGDRARJ-UHFFFAOYSA-N
Molecular Formula C18H12
7,035

6,12-Dibromochrysene 98.0+%, TCI America™

CAS: 131222-99-6 Molecular Formula: C18H10Br2 Molecular Weight (g/mol): 386.09 MDL Number: MFCD00092281 InChI Key: RULVBMDEPWAFIN-UHFFFAOYSA-N Synonym: 6,12-dibromochryscene,chrysene, 6,12-ibromo,chrysene, 6,12-dibromo,acmc-1c5x4,6,12-bis bromanyl chrysene,6,12-dibromochrysen PubChem CID: 3286225 IUPAC Name: 6,12-dibromochrysene SMILES: BrC1=CC2=C(C=C(Br)C3=CC=CC=C23)C2=CC=CC=C12

PubChem CID 3286225
CAS 131222-99-6
Molecular Weight (g/mol) 386.09
MDL Number MFCD00092281
SMILES BrC1=CC2=C(C=C(Br)C3=CC=CC=C23)C2=CC=CC=C12
Synonym 6,12-dibromochryscene,chrysene, 6,12-ibromo,chrysene, 6,12-dibromo,acmc-1c5x4,6,12-bis bromanyl chrysene,6,12-dibromochrysen
IUPAC Name 6,12-dibromochrysene
InChI Key RULVBMDEPWAFIN-UHFFFAOYSA-N
Molecular Formula C18H10Br2