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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)
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Naphthalenes (6,366)
Phenol esters (4,814)
Unsubstituted Phenols (1,453)
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Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
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Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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4,501 – 4,515 of 159,106 results
4,501

5-(4-Iodophenyl)isoxazole, 97%, Thermo Scientific™

CAS: 160377-48-0 Molecular Formula: C9H6INO Molecular Weight (g/mol): 271.057 MDL Number: MFCD02681898 InChI Key: TYNWYXFACGRXMG-UHFFFAOYSA-N Synonym: 5-4-iodophenyl isoxazole,5-4-iodophenyl-1,2-oxazole,isoxazole,5-4-iodophenyl PubChem CID: 2776370 IUPAC Name: 5-(4-iodophenyl)-1,2-oxazole SMILES: C1=CC(=CC=C1C2=CC=NO2)I

PubChem CID 2776370
CAS 160377-48-0
Molecular Weight (g/mol) 271.057
MDL Number MFCD02681898
SMILES C1=CC(=CC=C1C2=CC=NO2)I
Synonym 5-4-iodophenyl isoxazole,5-4-iodophenyl-1,2-oxazole,isoxazole,5-4-iodophenyl
IUPAC Name 5-(4-iodophenyl)-1,2-oxazole
InChI Key TYNWYXFACGRXMG-UHFFFAOYSA-N
Molecular Formula C9H6INO
4,502
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3-Nitrophthalic acid, 95%

CAS: 603-11-2 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.13 InChI Key: KFIRODWJCYBBHY-UHFFFAOYSA-N Synonym: 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid PubChem CID: 69043 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O

PubChem CID 69043
CAS 603-11-2
Molecular Weight (g/mol) 211.13
SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O
Synonym 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid
InChI Key KFIRODWJCYBBHY-UHFFFAOYSA-N
Molecular Formula C8H5NO6
4,503
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5,5-Dimethylhexane-2,4-dione, 99%

CAS: 7307-04-2 MDL Number: MFCD00142767

CAS 7307-04-2
MDL Number MFCD00142767
4,504
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3-Methoxy-4-nitrobenzoic acid, 98+%

CAS: 5081-36-7 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00007353 InChI Key: PWURRRRGLCVBMX-UHFFFAOYSA-N Synonym: 3-methoxy-4-nitrobenzoic acid,4-nitro-3-methoxybenzoic acid,4-nitro-m-anisic acid,benzoic acid, 3-methoxy-4-nitro,3-methoxy-4-nitrobenzoicacid,pubchem3918,acmc-1bn9s,ksc270m6t,3-methoxy4-nitro-benzoic acid,3-methoxy-4-nitro-benzoic acid PubChem CID: 78764 SMILES: COC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]

PubChem CID 78764
CAS 5081-36-7
Molecular Weight (g/mol) 197.146
MDL Number MFCD00007353
SMILES COC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]
Synonym 3-methoxy-4-nitrobenzoic acid,4-nitro-3-methoxybenzoic acid,4-nitro-m-anisic acid,benzoic acid, 3-methoxy-4-nitro,3-methoxy-4-nitrobenzoicacid,pubchem3918,acmc-1bn9s,ksc270m6t,3-methoxy4-nitro-benzoic acid,3-methoxy-4-nitro-benzoic acid
InChI Key PWURRRRGLCVBMX-UHFFFAOYSA-N
Molecular Formula C8H7NO5
4,505
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Ethyl 4-hydroxy-3-nitrobenzoate, 98%

CAS: 19013-10-6 Molecular Formula: C9H9NO5 Molecular Weight (g/mol): 211.173 MDL Number: MFCD00016999 InChI Key: FBHJNBWUGONVNS-UHFFFAOYSA-N Synonym: benzoic acid, 4-hydroxy-3-nitro-, ethyl ester,4-hydroxy-3-nitrobenzoic acid ethyl ester,acmc-20akyj,ethyl4-hydroxy-3-nitrobenzoate,ethyl 3-nitro-4-hydroxybenzoate,ethyl 4-hydroxy-3-nitro benzoate,3-nitro-4-hydroxybenzoic acid ethyl ester,4-hydroxy-3-nitro-benzoic acid ethyl ester PubChem CID: 87895 IUPAC Name: ethyl 4-hydroxy-3-nitrobenzoate SMILES: CCOC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

PubChem CID 87895
CAS 19013-10-6
Molecular Weight (g/mol) 211.173
MDL Number MFCD00016999
SMILES CCOC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
Synonym benzoic acid, 4-hydroxy-3-nitro-, ethyl ester,4-hydroxy-3-nitrobenzoic acid ethyl ester,acmc-20akyj,ethyl4-hydroxy-3-nitrobenzoate,ethyl 3-nitro-4-hydroxybenzoate,ethyl 4-hydroxy-3-nitro benzoate,3-nitro-4-hydroxybenzoic acid ethyl ester,4-hydroxy-3-nitro-benzoic acid ethyl ester
IUPAC Name ethyl 4-hydroxy-3-nitrobenzoate
InChI Key FBHJNBWUGONVNS-UHFFFAOYSA-N
Molecular Formula C9H9NO5
4,506
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1-Ethynylpyrene, 98%

CAS: 34993-56-1 Molecular Formula: C18H10 Molecular Weight (g/mol): 226.28 MDL Number: MFCD02093933 InChI Key: VEBUBSLYGRMOSZ-UHFFFAOYSA-N Synonym: 1-ethynyl pyrene,pyrene, 1-ethynyl,ethynylpyrene,1-pyrenylethyne,ccris 4256,acmc-20aov2 PubChem CID: 154905 IUPAC Name: 1-ethynylpyrene SMILES: C#CC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34

PubChem CID 154905
CAS 34993-56-1
Molecular Weight (g/mol) 226.28
MDL Number MFCD02093933
SMILES C#CC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34
Synonym 1-ethynyl pyrene,pyrene, 1-ethynyl,ethynylpyrene,1-pyrenylethyne,ccris 4256,acmc-20aov2
IUPAC Name 1-ethynylpyrene
InChI Key VEBUBSLYGRMOSZ-UHFFFAOYSA-N
Molecular Formula C18H10
4,507
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1-Pyrenecarboxaldehyde, 98+%

CAS: 3029-19-4 Molecular Formula: C17H10O Molecular Weight (g/mol): 230.266 MDL Number: MFCD00004139 InChI Key: RCYFOPUXRMOLQM-UHFFFAOYSA-N Synonym: 1-pyrenecarboxaldehyde,1-formylpyrene,1-pyrenealdehyde,pyrenecarboxaldehyde,3-formylpyrene,3-pyrenealdehyde,3-pyrenylaldehyde,pyrene-1-aldehyde,3-pyrenecarboxaldehyde,1-pyrenecarbaldehyde PubChem CID: 232848 IUPAC Name: pyrene-1-carbaldehyde SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O

PubChem CID 232848
CAS 3029-19-4
Molecular Weight (g/mol) 230.266
MDL Number MFCD00004139
SMILES C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O
Synonym 1-pyrenecarboxaldehyde,1-formylpyrene,1-pyrenealdehyde,pyrenecarboxaldehyde,3-formylpyrene,3-pyrenealdehyde,3-pyrenylaldehyde,pyrene-1-aldehyde,3-pyrenecarboxaldehyde,1-pyrenecarbaldehyde
IUPAC Name pyrene-1-carbaldehyde
InChI Key RCYFOPUXRMOLQM-UHFFFAOYSA-N
Molecular Formula C17H10O
4,508

1-Aminopyrene, 97%

CAS: 1606-67-3 Molecular Formula: C16H11N Molecular Weight (g/mol): 217.27 MDL Number: MFCD00004140 InChI Key: YZVWKHVRBDQPMQ-UHFFFAOYSA-N Synonym: 1-aminopyrene,1-pyrenamine,3-aminopyrene,pyrene, amino,pyren-1-ylamine,aminopyrene,pyrenamine,alpha-aminopyrene,unii-luw9eo1681,ccris 760 PubChem CID: 15352 IUPAC Name: pyren-1-amine SMILES: NC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34

PubChem CID 15352
CAS 1606-67-3
Molecular Weight (g/mol) 217.27
MDL Number MFCD00004140
SMILES NC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34
Synonym 1-aminopyrene,1-pyrenamine,3-aminopyrene,pyrene, amino,pyren-1-ylamine,aminopyrene,pyrenamine,alpha-aminopyrene,unii-luw9eo1681,ccris 760
IUPAC Name pyren-1-amine
InChI Key YZVWKHVRBDQPMQ-UHFFFAOYSA-N
Molecular Formula C16H11N
4,509
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1-Aminopyrene, 97%

CAS: 1606-67-3 Molecular Formula: C16H11N Molecular Weight (g/mol): 217.27 MDL Number: MFCD00004140 InChI Key: YZVWKHVRBDQPMQ-UHFFFAOYSA-N Synonym: 1-aminopyrene,1-pyrenamine,3-aminopyrene,pyrene, amino,pyren-1-ylamine,aminopyrene,pyrenamine,alpha-aminopyrene,unii-luw9eo1681,ccris 760 PubChem CID: 15352 IUPAC Name: pyren-1-amine SMILES: NC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34

PubChem CID 15352
CAS 1606-67-3
Molecular Weight (g/mol) 217.27
MDL Number MFCD00004140
SMILES NC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34
Synonym 1-aminopyrene,1-pyrenamine,3-aminopyrene,pyrene, amino,pyren-1-ylamine,aminopyrene,pyrenamine,alpha-aminopyrene,unii-luw9eo1681,ccris 760
IUPAC Name pyren-1-amine
InChI Key YZVWKHVRBDQPMQ-UHFFFAOYSA-N
Molecular Formula C16H11N
4,510
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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
4,511
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2-Bromo-4-nitrotoluene, 98%

CAS: 7745-93-9 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007195 InChI Key: XFZFJQHXWJIBQV-UHFFFAOYSA-N Synonym: 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene PubChem CID: 82189 IUPAC Name: 2-bromo-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])Br

PubChem CID 82189
CAS 7745-93-9
Molecular Weight (g/mol) 216.034
MDL Number MFCD00007195
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])Br
Synonym 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene
IUPAC Name 2-bromo-1-methyl-4-nitrobenzene
InChI Key XFZFJQHXWJIBQV-UHFFFAOYSA-N
Molecular Formula C7H6BrNO2
4,512
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2-Methyl-5-nitrobenzenesulfonyl chloride, 97%

CAS: 121-02-8 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.64 MDL Number: MFCD00051695 InChI Key: WPGVQDHXOUAJBW-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzene-1-sulfonyl chloride,5-nitro-o-toluenesulfonyl chloride,2-methyl-5-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methyl-5-nitro,4-nitrotoluen-2-sulfochlorid,o-toluenesulfonyl chloride, 5-nitro,4-nitrotoluen-2-sulfonylchlorid,4-nitrotoluene-2-sulphonyl chloride,4-nitrotoluen-2-sulfochlorid czech,2-methyl-5-nitrophenylsulfonyl chloride PubChem CID: 8457 IUPAC Name: 2-methyl-5-nitrobenzenesulfonyl chloride SMILES: CC1=CC=C(C=C1S(Cl)(=O)=O)[N+]([O-])=O

PubChem CID 8457
CAS 121-02-8
Molecular Weight (g/mol) 235.64
MDL Number MFCD00051695
SMILES CC1=CC=C(C=C1S(Cl)(=O)=O)[N+]([O-])=O
Synonym 2-methyl-5-nitrobenzene-1-sulfonyl chloride,5-nitro-o-toluenesulfonyl chloride,2-methyl-5-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methyl-5-nitro,4-nitrotoluen-2-sulfochlorid,o-toluenesulfonyl chloride, 5-nitro,4-nitrotoluen-2-sulfonylchlorid,4-nitrotoluene-2-sulphonyl chloride,4-nitrotoluen-2-sulfochlorid czech,2-methyl-5-nitrophenylsulfonyl chloride
IUPAC Name 2-methyl-5-nitrobenzenesulfonyl chloride
InChI Key WPGVQDHXOUAJBW-UHFFFAOYSA-N
Molecular Formula C7H6ClNO4S
4,513

2-(2-Methyl-6-nitrophenyl)acetic acid, 95%, Thermo Scientific Chemicals

CAS: 23876-18-8 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00066313 InChI Key: WFKNETIJXXWRHO-UHFFFAOYSA-N Synonym: 2-2-methyl-6-nitrophenyl acetic acid,2-methyl-6-nitrophenylacetic acid,2-methyl-6-nitrophenyl acetic acid,2-methyl-6-nitro-phenylacetic acid,2-6-methyl-2-nitrophenyl acetic acid PubChem CID: 675115 SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])CC(=O)O

PubChem CID 675115
CAS 23876-18-8
Molecular Weight (g/mol) 195.174
MDL Number MFCD00066313
SMILES CC1=C(C(=CC=C1)[N+](=O)[O-])CC(=O)O
Synonym 2-2-methyl-6-nitrophenyl acetic acid,2-methyl-6-nitrophenylacetic acid,2-methyl-6-nitrophenyl acetic acid,2-methyl-6-nitro-phenylacetic acid,2-6-methyl-2-nitrophenyl acetic acid
InChI Key WFKNETIJXXWRHO-UHFFFAOYSA-N
Molecular Formula C9H9NO4
4,514
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2-Methyl-5-nitroaniline, 98+%

CAS: 99-55-8 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007741 InChI Key: DSBIJCMXAIKKKI-UHFFFAOYSA-N Synonym: 2-amino-4-nitrotoluene,5-nitro-o-toluidine,fast scarlet g,pnot,scarlet g base,2-methyl-5-nitrobenzenamine,4-nitro-2-aminotoluene,devol scarlet b,diabase scarlet g,scarlet base nsp PubChem CID: 7444 ChEBI: CHEBI:66891 IUPAC Name: 2-methyl-5-nitroaniline SMILES: CC1=CC=C(C=C1N)[N+]([O-])=O

PubChem CID 7444
CAS 99-55-8
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:66891
MDL Number MFCD00007741
SMILES CC1=CC=C(C=C1N)[N+]([O-])=O
Synonym 2-amino-4-nitrotoluene,5-nitro-o-toluidine,fast scarlet g,pnot,scarlet g base,2-methyl-5-nitrobenzenamine,4-nitro-2-aminotoluene,devol scarlet b,diabase scarlet g,scarlet base nsp
IUPAC Name 2-methyl-5-nitroaniline
InChI Key DSBIJCMXAIKKKI-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
4,515
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4-Methyl-3-nitrobenzeneboronic acid, 98%

CAS: 80500-27-2 Molecular Formula: C7H8BNO4 Molecular Weight (g/mol): 180.954 MDL Number: MFCD00191550 InChI Key: OASVXBRTNVFKFS-UHFFFAOYSA-N Synonym: 4-methyl-3-nitrophenyl boronic acid,4-methyl-3-nitrobenzeneboronic acid,3-nitro-p-tolylboronic acid,4-methyl-3-nitrophenyl boranediol,4-methyl-3-nitro-phenyl boronic acid,3-nitro-4-methylphenylboronic acid,2-nitrotoluene-4-boronic acid,boronic acid, 4-methyl-3-nitrophenyl,3-nitro-4-methylbenzeneboronic acid PubChem CID: 2773515 IUPAC Name: (4-methyl-3-nitrophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C)[N+](=O)[O-])(O)O

PubChem CID 2773515
CAS 80500-27-2
Molecular Weight (g/mol) 180.954
MDL Number MFCD00191550
SMILES B(C1=CC(=C(C=C1)C)[N+](=O)[O-])(O)O
Synonym 4-methyl-3-nitrophenyl boronic acid,4-methyl-3-nitrobenzeneboronic acid,3-nitro-p-tolylboronic acid,4-methyl-3-nitrophenyl boranediol,4-methyl-3-nitro-phenyl boronic acid,3-nitro-4-methylphenylboronic acid,2-nitrotoluene-4-boronic acid,boronic acid, 4-methyl-3-nitrophenyl,3-nitro-4-methylbenzeneboronic acid
IUPAC Name (4-methyl-3-nitrophenyl)boronic acid
InChI Key OASVXBRTNVFKFS-UHFFFAOYSA-N
Molecular Formula C7H8BNO4