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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 (64,917)
Phenols (11,904)
Naphthalenes (4,958)
Fluorenes (1,242)
Unsubstituted Phenols (1,173)
Thiophenols (609)
Phenol esters (426)
Anthracenes (400)
Tetralins (329)
Phenanthrenes and derivatives (300)
Triphenyl compounds (290)
Indanes (288)
Pyrenes (217)
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Ellagic acids and derivatives (33)
Naphthacenes (31)
Acenaphthylenes (16)
Pentacenequinones (16)
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Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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3,601 – 3,615 of 73,799 results
3,601

4-Bromotoluene, 98%

CAS: 106-38-7 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000109 InChI Key: ZBTMRBYMKUEVEU-UHFFFAOYSA-N Synonym: 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene PubChem CID: 7805 IUPAC Name: 1-bromo-4-methylbenzene SMILES: CC1=CC=C(Br)C=C1

PubChem CID 7805
CAS 106-38-7
Molecular Weight (g/mol) 171.04
MDL Number MFCD00000109
SMILES CC1=CC=C(Br)C=C1
Synonym 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene
IUPAC Name 1-bromo-4-methylbenzene
InChI Key ZBTMRBYMKUEVEU-UHFFFAOYSA-N
Molecular Formula C7H7Br
3,602

2-Amino-5-chlorobenzophenone, 98%

CAS: 719-59-5 Molecular Formula: C13H10ClNO Molecular Weight (g/mol): 231.68 MDL Number: MFCD00007839 InChI Key: ZUWXHHBROGLWNH-UHFFFAOYSA-N Synonym: 2-amino-5-chlorobenzophenone,2-amino-5-chlorophenyl phenyl methanone,2-benzoyl-4-chloroaniline,methanone, 2-amino-5-chlorophenyl phenyl,2-amino-5-chlorbenzophenone,5-chloro-2-aminobenzophenone,2-amino-5-chlorobenzylphenone,benzophenone, 2-amino-5-chloro,unii-fr80014zbt,2-amino-5-chlorophenyl phenylmethanone PubChem CID: 12870 IUPAC Name: (2-amino-5-chlorophenyl)-phenylmethanone SMILES: NC1=CC=C(Cl)C=C1C(=O)C1=CC=CC=C1

PubChem CID 12870
CAS 719-59-5
Molecular Weight (g/mol) 231.68
MDL Number MFCD00007839
SMILES NC1=CC=C(Cl)C=C1C(=O)C1=CC=CC=C1
Synonym 2-amino-5-chlorobenzophenone,2-amino-5-chlorophenyl phenyl methanone,2-benzoyl-4-chloroaniline,methanone, 2-amino-5-chlorophenyl phenyl,2-amino-5-chlorbenzophenone,5-chloro-2-aminobenzophenone,2-amino-5-chlorobenzylphenone,benzophenone, 2-amino-5-chloro,unii-fr80014zbt,2-amino-5-chlorophenyl phenylmethanone
IUPAC Name (2-amino-5-chlorophenyl)-phenylmethanone
InChI Key ZUWXHHBROGLWNH-UHFFFAOYSA-N
Molecular Formula C13H10ClNO
3,603

4-Bromo-3,5-dimethylphenol, 99%

CAS: 7463-51-6 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00002315 InChI Key: WMUWDPLTTLJNPE-UHFFFAOYSA-N Synonym: 4-bromo-3,5-xylenol,4-bromo-3,5-dimethyl phenol,phenol, 4-bromo-3,5-dimethyl,3,5-dimethyl-4-bromophenol,4-bromo-3,5-dimethyl-phenol,zlchem 241,pubchem3767,acmc-209ovl,3,5-xylenol, 4-bromo,akos bbb/606 PubChem CID: 81970 IUPAC Name: 4-bromo-3,5-dimethylphenol SMILES: CC1=CC(=CC(=C1Br)C)O

PubChem CID 81970
CAS 7463-51-6
Molecular Weight (g/mol) 201.06
MDL Number MFCD00002315
SMILES CC1=CC(=CC(=C1Br)C)O
Synonym 4-bromo-3,5-xylenol,4-bromo-3,5-dimethyl phenol,phenol, 4-bromo-3,5-dimethyl,3,5-dimethyl-4-bromophenol,4-bromo-3,5-dimethyl-phenol,zlchem 241,pubchem3767,acmc-209ovl,3,5-xylenol, 4-bromo,akos bbb/606
IUPAC Name 4-bromo-3,5-dimethylphenol
InChI Key WMUWDPLTTLJNPE-UHFFFAOYSA-N
Molecular Formula C8H9BrO
3,604

4-Bromobenzonitrile, 98%

CAS: 623-00-7 Molecular Formula: C7H4BrN Molecular Weight (g/mol): 182.02 MDL Number: MFCD00001811 InChI Key: HQSCPPCMBMFJJN-UHFFFAOYSA-N Synonym: p-bromobenzonitrile,benzonitrile, 4-bromo,benzonitrile, p-bromo,1-bromo-4-cyanobenzene,4-bromo benzonitrile,4-cyano-bromobenzene,4-bromo-4'-cyanobenzene,4-cyanobromobenzene,bromobenzonitrile-4,4-bromocyanobenzene PubChem CID: 12162 IUPAC Name: 4-bromobenzonitrile SMILES: BrC1=CC=C(C=C1)C#N

PubChem CID 12162
CAS 623-00-7
Molecular Weight (g/mol) 182.02
MDL Number MFCD00001811
SMILES BrC1=CC=C(C=C1)C#N
Synonym p-bromobenzonitrile,benzonitrile, 4-bromo,benzonitrile, p-bromo,1-bromo-4-cyanobenzene,4-bromo benzonitrile,4-cyano-bromobenzene,4-bromo-4'-cyanobenzene,4-cyanobromobenzene,bromobenzonitrile-4,4-bromocyanobenzene
IUPAC Name 4-bromobenzonitrile
InChI Key HQSCPPCMBMFJJN-UHFFFAOYSA-N
Molecular Formula C7H4BrN
3,605

Cinnamyl bromide, 97%, predominantly trans

CAS: 4392-24-9 Molecular Formula: C9H9Br Molecular Weight (g/mol): 197.07 MDL Number: MFCD00000245 InChI Key: RUROFEVDCUGKHD-QPJJXVBHSA-N Synonym: cinnamyl bromide,3-bromoprop-1-en-1-yl benzene,e-3-bromoprop-1-en-1-yl benzene,3-bromo-1-phenyl-1-propene,3-bromo-1-phenyl propene-1,e-3-bromoprop-1-enyl benzene,3-bromo-propenyl-benzene,e-cinnamyl bromide,trans-cinnamyl bromide PubChem CID: 5357478 IUPAC Name: [(E)-3-bromoprop-1-enyl]benzene SMILES: C1=CC=C(C=C1)C=CCBr

PubChem CID 5357478
CAS 4392-24-9
Molecular Weight (g/mol) 197.07
MDL Number MFCD00000245
SMILES C1=CC=C(C=C1)C=CCBr
Synonym cinnamyl bromide,3-bromoprop-1-en-1-yl benzene,e-3-bromoprop-1-en-1-yl benzene,3-bromo-1-phenyl-1-propene,3-bromo-1-phenyl propene-1,e-3-bromoprop-1-enyl benzene,3-bromo-propenyl-benzene,e-cinnamyl bromide,trans-cinnamyl bromide
IUPAC Name [(E)-3-bromoprop-1-enyl]benzene
InChI Key RUROFEVDCUGKHD-QPJJXVBHSA-N
Molecular Formula C9H9Br
3,606

2,6-Dihydroxynaphthalene, 97%

CAS: 581-43-1 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 InChI Key: MNZMMCVIXORAQL-UHFFFAOYSA-N Synonym: 2,6-dihydroxynaphthalene,2,6-naphthalenediol,2,6-naphthohydroquinone,2-hydroxy-6-naphthol,unii-4xx2nd0257,2,6-dihydroxy naphthalene,2,6-dihdroxynaphthalene,2,6-dihydroxy-naphthalene,acmc-209m2x,aronis24267 PubChem CID: 93552 IUPAC Name: naphthalene-2,6-diol SMILES: C1=CC2=C(C=CC(=C2)O)C=C1O

PubChem CID 93552
CAS 581-43-1
Molecular Weight (g/mol) 160.17
SMILES C1=CC2=C(C=CC(=C2)O)C=C1O
Synonym 2,6-dihydroxynaphthalene,2,6-naphthalenediol,2,6-naphthohydroquinone,2-hydroxy-6-naphthol,unii-4xx2nd0257,2,6-dihydroxy naphthalene,2,6-dihdroxynaphthalene,2,6-dihydroxy-naphthalene,acmc-209m2x,aronis24267
IUPAC Name naphthalene-2,6-diol
InChI Key MNZMMCVIXORAQL-UHFFFAOYSA-N
Molecular Formula C10H8O2
3,607

4-Chlorobenzyl cyanide, 98+%

CAS: 140-53-4 Molecular Formula: C8H6ClN Molecular Weight (g/mol): 151.6 MDL Number: MFCD00001918 InChI Key: IVYMIRMKXZAHRV-UHFFFAOYSA-N Synonym: 4-chlorobenzyl cyanide,4-chlorophenyl acetonitrile,4-chlorophenylacetonitrile,2-4-chlorophenyl acetonitrile,p-chlorobenzyl cyanide,4-chlorobenzeneacetonitrile,benzeneacetonitrile, 4-chloro,p-chlorophenyl acetonitrile,p-chlorophenylacetonitrile,4-chlorobenzylcyanide PubChem CID: 241582 ChEBI: CHEBI:17346 IUPAC Name: 2-(4-chlorophenyl)acetonitrile SMILES: C1=CC(=CC=C1CC#N)Cl

PubChem CID 241582
CAS 140-53-4
Molecular Weight (g/mol) 151.6
ChEBI CHEBI:17346
MDL Number MFCD00001918
SMILES C1=CC(=CC=C1CC#N)Cl
Synonym 4-chlorobenzyl cyanide,4-chlorophenyl acetonitrile,4-chlorophenylacetonitrile,2-4-chlorophenyl acetonitrile,p-chlorobenzyl cyanide,4-chlorobenzeneacetonitrile,benzeneacetonitrile, 4-chloro,p-chlorophenyl acetonitrile,p-chlorophenylacetonitrile,4-chlorobenzylcyanide
IUPAC Name 2-(4-chlorophenyl)acetonitrile
InChI Key IVYMIRMKXZAHRV-UHFFFAOYSA-N
Molecular Formula C8H6ClN
3,608

3,5-Dimethoxyaniline, 98%

CAS: 10272-07-8 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.18 MDL Number: MFCD00008392 InChI Key: WNRGWPVJGDABME-UHFFFAOYSA-N Synonym: benzenamine, 3,5-dimethoxy,3,5-dimethoxybenzeneamine,5-aminoresorcinol dimethyl ether,3,5-dimethoxy-phenylamine,3,5-dimethoxyanaline,3,5-dimethoxy aniline,5-aminoresorcinol dimethylether,3,5-dimethoxybenzenamine,3,5-dimethoxyphenylamine,pubchem4423 PubChem CID: 66301 IUPAC Name: 3,5-dimethoxyaniline SMILES: COC1=CC(OC)=CC(N)=C1

PubChem CID 66301
CAS 10272-07-8
Molecular Weight (g/mol) 153.18
MDL Number MFCD00008392
SMILES COC1=CC(OC)=CC(N)=C1
Synonym benzenamine, 3,5-dimethoxy,3,5-dimethoxybenzeneamine,5-aminoresorcinol dimethyl ether,3,5-dimethoxy-phenylamine,3,5-dimethoxyanaline,3,5-dimethoxy aniline,5-aminoresorcinol dimethylether,3,5-dimethoxybenzenamine,3,5-dimethoxyphenylamine,pubchem4423
IUPAC Name 3,5-dimethoxyaniline
InChI Key WNRGWPVJGDABME-UHFFFAOYSA-N
Molecular Formula C8H11NO2
3,609

3,5-Dichlorophenol, 99%

CAS: 591-35-5 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163 MDL Number: MFCD00002259 InChI Key: VPOMSPZBQMDLTM-UHFFFAOYSA-N Synonym: phenol, 3,5-dichloro,3,5-dichloro-phenol,unii-fg32l88ko9,3,5 dichlorophenol,ccris 5905,3,5-dichloro phenol,pubchem3699,acmc-209mar,dsstox_cid_5006,dsstox_rid_77624 PubChem CID: 11571 IUPAC Name: 3,5-dichlorophenol SMILES: C1=C(C=C(C=C1Cl)Cl)O

PubChem CID 11571
CAS 591-35-5
Molecular Weight (g/mol) 163
MDL Number MFCD00002259
SMILES C1=C(C=C(C=C1Cl)Cl)O
Synonym phenol, 3,5-dichloro,3,5-dichloro-phenol,unii-fg32l88ko9,3,5 dichlorophenol,ccris 5905,3,5-dichloro phenol,pubchem3699,acmc-209mar,dsstox_cid_5006,dsstox_rid_77624
IUPAC Name 3,5-dichlorophenol
InChI Key VPOMSPZBQMDLTM-UHFFFAOYSA-N
Molecular Formula C6H4Cl2O
3,610

4-Iodoanisole, 98%

CAS: 696-62-8 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.04 InChI Key: SYSZENVIJHPFNL-UHFFFAOYSA-N Synonym: 4-iodoanisole,p-iodoanisole,benzene, 1-iodo-4-methoxy,isoform,4-methoxyiodobenzene,p-methoxyiodobenzene,anisole, p-iodo,4-iodomethoxybenzene,p-iodophenyl methyl ether,1-iodo-4-methoxy-benzene PubChem CID: 69676 IUPAC Name: 1-iodo-4-methoxybenzene SMILES: COC1=CC=C(C=C1)I

PubChem CID 69676
CAS 696-62-8
Molecular Weight (g/mol) 234.04
SMILES COC1=CC=C(C=C1)I
Synonym 4-iodoanisole,p-iodoanisole,benzene, 1-iodo-4-methoxy,isoform,4-methoxyiodobenzene,p-methoxyiodobenzene,anisole, p-iodo,4-iodomethoxybenzene,p-iodophenyl methyl ether,1-iodo-4-methoxy-benzene
IUPAC Name 1-iodo-4-methoxybenzene
InChI Key SYSZENVIJHPFNL-UHFFFAOYSA-N
Molecular Formula C7H7IO
3,611

Dibenzylamine, 98%

CAS: 103-49-1 Molecular Formula: C14H15N Molecular Weight (g/mol): 197.28 MDL Number: MFCD00004770 InChI Key: BWLUMTFWVZZZND-UHFFFAOYSA-N Synonym: dibenzylamine,benzenemethanamine, n-phenylmethyl,n-benzylbenzylamine,bibenzylamine,dibenzyl-amine,dibenzyl amine,bisbenzylamine,n,n-dibenzylamine,n-benzylaminomethyl benzene,unii-3g0yfx01c6 PubChem CID: 7656 SMILES: C(NCC1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 7656
CAS 103-49-1
Molecular Weight (g/mol) 197.28
MDL Number MFCD00004770
SMILES C(NCC1=CC=CC=C1)C1=CC=CC=C1
Synonym dibenzylamine,benzenemethanamine, n-phenylmethyl,n-benzylbenzylamine,bibenzylamine,dibenzyl-amine,dibenzyl amine,bisbenzylamine,n,n-dibenzylamine,n-benzylaminomethyl benzene,unii-3g0yfx01c6
InChI Key BWLUMTFWVZZZND-UHFFFAOYSA-N
Molecular Formula C14H15N
3,612

(3,4-Dimethoxyphenyl)acetic acid, 99%

CAS: 93-40-3 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.2 MDL Number: MFCD00004335 InChI Key: WUAXWQRULBZETB-UHFFFAOYSA-N Synonym: homoveratric acid,3,4-dimethoxyphenylacetic acid,3,4-dimethoxyphenyl acetic acid,2-3,4-dimethoxyphenyl acetic acid,benzeneacetic acid, 3,4-dimethoxy,3,4-dimethoxybenzeneacetic acid,3,4-dimethoxy-phenyl-acetic acid,acetic acid, 3,4-dimethoxyphenyl PubChem CID: 7139 ChEBI: CHEBI:86655 IUPAC Name: 2-(3,4-dimethoxyphenyl)acetic acid SMILES: COC1=C(C=C(C=C1)CC(=O)O)OC

PubChem CID 7139
CAS 93-40-3
Molecular Weight (g/mol) 196.2
ChEBI CHEBI:86655
MDL Number MFCD00004335
SMILES COC1=C(C=C(C=C1)CC(=O)O)OC
Synonym homoveratric acid,3,4-dimethoxyphenylacetic acid,3,4-dimethoxyphenyl acetic acid,2-3,4-dimethoxyphenyl acetic acid,benzeneacetic acid, 3,4-dimethoxy,3,4-dimethoxybenzeneacetic acid,3,4-dimethoxy-phenyl-acetic acid,acetic acid, 3,4-dimethoxyphenyl
IUPAC Name 2-(3,4-dimethoxyphenyl)acetic acid
InChI Key WUAXWQRULBZETB-UHFFFAOYSA-N
Molecular Formula C10H12O4
3,613

2-Fluoroaniline, 99+%

CAS: 348-54-9 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007642 InChI Key: FTZQXOJYPFINKJ-UHFFFAOYSA-N Synonym: o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine PubChem CID: 9584 ChEBI: CHEBI:27526 IUPAC Name: 2-fluoroaniline SMILES: NC1=CC=CC=C1F

PubChem CID 9584
CAS 348-54-9
Molecular Weight (g/mol) 111.12
ChEBI CHEBI:27526
MDL Number MFCD00007642
SMILES NC1=CC=CC=C1F
Synonym o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine
IUPAC Name 2-fluoroaniline
InChI Key FTZQXOJYPFINKJ-UHFFFAOYSA-N
Molecular Formula C6H6FN
3,614

N-(Diphenylmethylene)aminoacetonitrile, 99%

CAS: 70591-20-7 Molecular Formula: C15H12N2 Molecular Weight (g/mol): 220.28 MDL Number: MFCD00009970 InChI Key: VRLJFRODHVSTIK-UHFFFAOYSA-N Synonym: n-diphenylmethylene aminoacetonitrile,2-diphenylmethylene amino acetonitrile,benzhydrylidene-amino-acetonitrile,2-benzhydrylideneamino acetonitrile,2-diphenylmethylidene amino acetonitrile,acetonitrile, diphenylmethylene amino,4,4-diphenyl-3-azabut-3-enenitrile,pubchem13883,benzhydrylideneaminoacetonitrile PubChem CID: 612957 IUPAC Name: 2-(benzhydrylideneamino)acetonitrile SMILES: N#CCN=C(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 612957
CAS 70591-20-7
Molecular Weight (g/mol) 220.28
MDL Number MFCD00009970
SMILES N#CCN=C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym n-diphenylmethylene aminoacetonitrile,2-diphenylmethylene amino acetonitrile,benzhydrylidene-amino-acetonitrile,2-benzhydrylideneamino acetonitrile,2-diphenylmethylidene amino acetonitrile,acetonitrile, diphenylmethylene amino,4,4-diphenyl-3-azabut-3-enenitrile,pubchem13883,benzhydrylideneaminoacetonitrile
IUPAC Name 2-(benzhydrylideneamino)acetonitrile
InChI Key VRLJFRODHVSTIK-UHFFFAOYSA-N
Molecular Formula C15H12N2
3,615

4-Methyl-2-nitroaniline, 99%

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC=C(N)C(=C1)[N+]([O-])=O

PubChem CID 6978
CAS 89-62-3
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:66920
MDL Number MFCD00007907
SMILES CC1=CC=C(N)C(=C1)[N+]([O-])=O
Synonym 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt
IUPAC Name 4-methyl-2-nitroaniline
InChI Key DLURHXYXQYMPLT-UHFFFAOYSA-N
Molecular Formula C7H8N2O2