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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 (67,766)
Phenols (13,514)
Naphthalenes (5,075)
Fluorenes (1,235)
Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (413)
Phenanthrenes and derivatives (327)
Tetralins (327)
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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5,971 – 5,985 of 78,691 results
5,971

3-Amino-4-chlorobenzamide, 97%

CAS: 19694-10-1 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.60 MDL Number: MFCD00035785 InChI Key: QHMDKGRWJVOUFU-UHFFFAOYSA-N PubChem CID: 88200 IUPAC Name: 3-amino-4-chlorobenzamide SMILES: NC(=O)C1=CC=C(Cl)C(N)=C1

PubChem CID 88200
CAS 19694-10-1
Molecular Weight (g/mol) 170.60
MDL Number MFCD00035785
SMILES NC(=O)C1=CC=C(Cl)C(N)=C1
IUPAC Name 3-amino-4-chlorobenzamide
InChI Key QHMDKGRWJVOUFU-UHFFFAOYSA-N
Molecular Formula C7H7ClN2O
5,972

4-Bromo-1-fluoro-2-nitrobenzene, 98%

CAS: 364-73-8 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 220.00 MDL Number: MFCD00129165 InChI Key: UQEANKGXXSENNF-UHFFFAOYSA-N Synonym: 5-bromo-2-fluoronitrobenzene,1-bromo-4-fluoro-3-nitrobenzene,2-fluoro-5-bromonitrobenzene,4-bromo-1-fluoro-2-nitro-benzene,benzene, 4-bromo-1-fluoro-2-nitro,pubchem1046,5-bromo-fluoronitrobenzene,acmc-1cpc6,5-bromo-2-fluronitrobenzene,ksc226i7f PubChem CID: 2736328 IUPAC Name: 4-bromo-1-fluoro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC(Br)=CC=C1F

PubChem CID 2736328
CAS 364-73-8
Molecular Weight (g/mol) 220.00
MDL Number MFCD00129165
SMILES [O-][N+](=O)C1=CC(Br)=CC=C1F
Synonym 5-bromo-2-fluoronitrobenzene,1-bromo-4-fluoro-3-nitrobenzene,2-fluoro-5-bromonitrobenzene,4-bromo-1-fluoro-2-nitro-benzene,benzene, 4-bromo-1-fluoro-2-nitro,pubchem1046,5-bromo-fluoronitrobenzene,acmc-1cpc6,5-bromo-2-fluronitrobenzene,ksc226i7f
IUPAC Name 4-bromo-1-fluoro-2-nitrobenzene
InChI Key UQEANKGXXSENNF-UHFFFAOYSA-N
Molecular Formula C6H3BrFNO2
5,973

2-(Trifluoromethyl)phenyl isothiocyanate, 98%

CAS: 1743-86-8 Molecular Formula: C8H4F3NS Molecular Weight (g/mol): 203.182 MDL Number: MFCD00039644 InChI Key: FCEKLQPJGXIQRY-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester PubChem CID: 737162 IUPAC Name: 1-isothiocyanato-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)N=C=S

PubChem CID 737162
CAS 1743-86-8
Molecular Weight (g/mol) 203.182
MDL Number MFCD00039644
SMILES C1=CC=C(C(=C1)C(F)(F)F)N=C=S
Synonym 2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester
IUPAC Name 1-isothiocyanato-2-(trifluoromethyl)benzene
InChI Key FCEKLQPJGXIQRY-UHFFFAOYSA-N
Molecular Formula C8H4F3NS
5,974

4-Methoxy-2-nitroaniline, 97%

CAS: 96-96-8 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00007152 InChI Key: QFMJFXFXQAFGBO-UHFFFAOYSA-N Synonym: 2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt PubChem CID: 66793 ChEBI: CHEBI:48973 IUPAC Name: 4-methoxy-2-nitroaniline SMILES: COC1=CC(=C(C=C1)N)[N+](=O)[O-]

PubChem CID 66793
CAS 96-96-8
Molecular Weight (g/mol) 168.15
ChEBI CHEBI:48973
MDL Number MFCD00007152
SMILES COC1=CC(=C(C=C1)N)[N+](=O)[O-]
Synonym 2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt
IUPAC Name 4-methoxy-2-nitroaniline
InChI Key QFMJFXFXQAFGBO-UHFFFAOYSA-N
Molecular Formula C7H8N2O3
5,975

Methyltriphenylphosphonium chloride, 97%, Thermo Scientific Chemicals

CAS: 1031-15-8 Molecular Formula: C19H18ClP Molecular Weight (g/mol): 312.78 MDL Number: MFCD00797851 InChI Key: QRPRIOOKPZSVFN-UHFFFAOYSA-M Synonym: methyltriphenylphosphonium chloride,methyl triphenyl phosphonium chloride,phosphonium, methyltriphenyl-, chloride,methyltriphenylphosphanium chloride,methyltriphenylphosphoniumchloride,methyl triphenylphosphoniumchloride,methyl triphenylphosphonium chloride,methyl triphenyl phosphanium chloride PubChem CID: 9879809 IUPAC Name: methyl(triphenyl)phosphanium;chloride SMILES: [Cl-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 9879809
CAS 1031-15-8
Molecular Weight (g/mol) 312.78
MDL Number MFCD00797851
SMILES [Cl-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym methyltriphenylphosphonium chloride,methyl triphenyl phosphonium chloride,phosphonium, methyltriphenyl-, chloride,methyltriphenylphosphanium chloride,methyltriphenylphosphoniumchloride,methyl triphenylphosphoniumchloride,methyl triphenylphosphonium chloride,methyl triphenyl phosphanium chloride
IUPAC Name methyl(triphenyl)phosphanium;chloride
InChI Key QRPRIOOKPZSVFN-UHFFFAOYSA-M
Molecular Formula C19H18ClP
5,976

Racepinephrine Hydrochloride, USP, 97-102%, Spectrum™ Chemical
SDP

CAS: 329-63-5 Molecular Formula: C9H14ClNO3 Molecular Weight (g/mol): 219.67 InChI Key: ATADHKWKHYVBTJ-UHFFFAOYNA-N IUPAC Name: hydrogen 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol chloride SMILES: [H+].[Cl-].CNCC(O)C1=CC=C(O)C(O)=C1

CAS 329-63-5
Molecular Weight (g/mol) 219.67
SMILES [H+].[Cl-].CNCC(O)C1=CC=C(O)C(O)=C1
IUPAC Name hydrogen 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol chloride
InChI Key ATADHKWKHYVBTJ-UHFFFAOYNA-N
Molecular Formula C9H14ClNO3
5,977

4-(Trifluoromethoxy)benzylamine, 97%

CAS: 93919-56-3 MDL Number: MFCD00061237 InChI Key: DBGROTRFYBSUTR-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzylamine,4-trifluoromethoxy phenyl methanamine,1-4-trifluoromethoxy phenyl methanamine,4-trifluoromethoxybenzylamine,benzenemethanamine, 4-trifluoromethoxy,p-trifluoromethoxybenzylamine,p-trifluoromethoxy benzylamine,4-trifluoromethoxy benzyl amine,4-trifluoromethoxy phenyl methylamine PubChem CID: 571846 IUPAC Name: [4-(trifluoromethoxy)phenyl]methanamine SMILES: C1=CC(=CC=C1CN)OC(F)(F)F

PubChem CID 571846
CAS 93919-56-3
MDL Number MFCD00061237
SMILES C1=CC(=CC=C1CN)OC(F)(F)F
Synonym 4-trifluoromethoxy benzylamine,4-trifluoromethoxy phenyl methanamine,1-4-trifluoromethoxy phenyl methanamine,4-trifluoromethoxybenzylamine,benzenemethanamine, 4-trifluoromethoxy,p-trifluoromethoxybenzylamine,p-trifluoromethoxy benzylamine,4-trifluoromethoxy benzyl amine,4-trifluoromethoxy phenyl methylamine
IUPAC Name [4-(trifluoromethoxy)phenyl]methanamine
InChI Key DBGROTRFYBSUTR-UHFFFAOYSA-N
5,978

4-Fluorobenzoic acid, 98%

CAS: 456-22-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002530 InChI Key: BBYDXOIZLAWGSL-UHFFFAOYSA-N Synonym: p-fluorobenzoic acid,benzoic acid, 4-fluoro,para-fluorobenzoic acid,4-fluoro-benzoic acid,benzoic acid, p-fluoro,unii-v5roo2hou4,p-fluoro-benzoic acid,v5roo2hou4,4-fluorobenzoatd,p-flurobenzoic acid PubChem CID: 9973 ChEBI: CHEBI:20364 IUPAC Name: 4-fluorobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)F

PubChem CID 9973
CAS 456-22-4
Molecular Weight (g/mol) 140.113
ChEBI CHEBI:20364
MDL Number MFCD00002530
SMILES C1=CC(=CC=C1C(=O)O)F
Synonym p-fluorobenzoic acid,benzoic acid, 4-fluoro,para-fluorobenzoic acid,4-fluoro-benzoic acid,benzoic acid, p-fluoro,unii-v5roo2hou4,p-fluoro-benzoic acid,v5roo2hou4,4-fluorobenzoatd,p-flurobenzoic acid
IUPAC Name 4-fluorobenzoic acid
InChI Key BBYDXOIZLAWGSL-UHFFFAOYSA-N
Molecular Formula C7H5FO2
5,979

4-Bromomethyl-3-nitrobenzoic acid, 97%

CAS: 55715-03-2 Molecular Formula: C8H6BrNO4 Molecular Weight (g/mol): 260.043 MDL Number: MFCD00216575 InChI Key: QMAHVAFURJBOFV-UHFFFAOYSA-N Synonym: 4-bromomethyl-3-nitrobenzoic acid,4-bromomethyl-3-nitrobenzoicacid,benzoic acid, 4-bromomethyl-3-nitro,3-nitro-4-bromomethylbenzoic acid,bnba,acmc-1auor,ksc495i9f,3-nitro-4-bromomethyl benzoic acid,4-bromomethyl-3-nitro benzoic acid PubChem CID: 132386 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])CBr

PubChem CID 132386
CAS 55715-03-2
Molecular Weight (g/mol) 260.043
MDL Number MFCD00216575
SMILES C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])CBr
Synonym 4-bromomethyl-3-nitrobenzoic acid,4-bromomethyl-3-nitrobenzoicacid,benzoic acid, 4-bromomethyl-3-nitro,3-nitro-4-bromomethylbenzoic acid,bnba,acmc-1auor,ksc495i9f,3-nitro-4-bromomethyl benzoic acid,4-bromomethyl-3-nitro benzoic acid
InChI Key QMAHVAFURJBOFV-UHFFFAOYSA-N
Molecular Formula C8H6BrNO4
5,980

3-Fluoro-4-hydroxybenzeneboronic acid, 97%

CAS: 182344-14-5 Molecular Formula: C6H6BFO3 Molecular Weight (g/mol): 155.919 MDL Number: MFCD06659838 InChI Key: OYNDLOJPYURCJG-UHFFFAOYSA-N Synonym: 3-fluoro-4-hydroxyphenyl boronic acid,4-borono-2-fluorophenol,boronic acid, 3-fluoro-4-hydroxyphenyl,3-fluoro-4-hydroxybenzeneboronic acid,pubchem18807,acmc-1c2s7,3-fluoro-4-hydroxy-phenylboronic acid,4-hydroxy-3-fluorophenyl boronic acid,3-fluoro-4-hydroxyphenyl-boronic acid PubChem CID: 23005361 IUPAC Name: (3-fluoro-4-hydroxyphenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)O)F)(O)O

PubChem CID 23005361
CAS 182344-14-5
Molecular Weight (g/mol) 155.919
MDL Number MFCD06659838
SMILES B(C1=CC(=C(C=C1)O)F)(O)O
Synonym 3-fluoro-4-hydroxyphenyl boronic acid,4-borono-2-fluorophenol,boronic acid, 3-fluoro-4-hydroxyphenyl,3-fluoro-4-hydroxybenzeneboronic acid,pubchem18807,acmc-1c2s7,3-fluoro-4-hydroxy-phenylboronic acid,4-hydroxy-3-fluorophenyl boronic acid,3-fluoro-4-hydroxyphenyl-boronic acid
IUPAC Name (3-fluoro-4-hydroxyphenyl)boronic acid
InChI Key OYNDLOJPYURCJG-UHFFFAOYSA-N
Molecular Formula C6H6BFO3
5,981

1-Benzyloxy-4-iodobenzene, 98+%

CAS: 19578-68-8 Molecular Formula: C13H11IO Molecular Weight (g/mol): 310.134 MDL Number: MFCD00079704 InChI Key: MPWFGAWFTAZWKZ-UHFFFAOYSA-N PubChem CID: 519671 IUPAC Name: 1-iodo-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)I

PubChem CID 519671
CAS 19578-68-8
Molecular Weight (g/mol) 310.134
MDL Number MFCD00079704
SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)I
IUPAC Name 1-iodo-4-phenylmethoxybenzene
InChI Key MPWFGAWFTAZWKZ-UHFFFAOYSA-N
Molecular Formula C13H11IO
5,982

4-Cyano-4'-n-pentylbiphenyl, 99%

CAS: 40817-08-1 Molecular Formula: C18H19N Molecular Weight (g/mol): 249.357 MDL Number: MFCD00036350 InChI Key: HHPCNRKYVYWYAU-UHFFFAOYSA-N Synonym: 4-cyano-4'-pentylbiphenyl,4'-pentyl-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-n-pentylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-pentyl,4'-pentyl-4-biphenylcarbonitrile,4-pentyl-4'-cyanobiphenyl,4'-amyl-4-biphenylcarbonitrile,4'-pentylbiphenyl-4-carbonitrile,4-amyl-4'-cyanobiphenyl,4-n-pentyl-4'-cyanobiphenyl PubChem CID: 92319 IUPAC Name: 4-(4-pentylphenyl)benzonitrile SMILES: CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

PubChem CID 92319
CAS 40817-08-1
Molecular Weight (g/mol) 249.357
MDL Number MFCD00036350
SMILES CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
Synonym 4-cyano-4'-pentylbiphenyl,4'-pentyl-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-n-pentylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-pentyl,4'-pentyl-4-biphenylcarbonitrile,4-pentyl-4'-cyanobiphenyl,4'-amyl-4-biphenylcarbonitrile,4'-pentylbiphenyl-4-carbonitrile,4-amyl-4'-cyanobiphenyl,4-n-pentyl-4'-cyanobiphenyl
IUPAC Name 4-(4-pentylphenyl)benzonitrile
InChI Key HHPCNRKYVYWYAU-UHFFFAOYSA-N
Molecular Formula C18H19N
5,983

3-Hydroxy-2,4,6-tribromobenzoic acid, 97%, Thermo Scientific Chemicals

CAS: 14348-40-4 Molecular Formula: C7H3Br3O3 Molecular Weight (g/mol): 374.84 MDL Number: MFCD00055557 InChI Key: YDBHVMTTYXWHLI-UHFFFAOYSA-N Synonym: 3-hydroxy-2,4,6-tribromobenzoic acid,tbhba,benzoic acid, 2,4,6-tribromo-3-hydroxy,2,4,6-tribromo-3-hydroxybenzoicacid,2,4,6-thba,pubchem12541,acmc-209uep,ksc174o3h,2,4,6-tribromo-3-hydroxy-benzoic acid,2,4,6-tribromo-3-hydroxybenzoic acid PubChem CID: 151915 IUPAC Name: 2,4,6-tribromo-3-hydroxybenzoic acid SMILES: C1=C(C(=C(C(=C1Br)O)Br)C(=O)O)Br

PubChem CID 151915
CAS 14348-40-4
Molecular Weight (g/mol) 374.84
MDL Number MFCD00055557
SMILES C1=C(C(=C(C(=C1Br)O)Br)C(=O)O)Br
Synonym 3-hydroxy-2,4,6-tribromobenzoic acid,tbhba,benzoic acid, 2,4,6-tribromo-3-hydroxy,2,4,6-tribromo-3-hydroxybenzoicacid,2,4,6-thba,pubchem12541,acmc-209uep,ksc174o3h,2,4,6-tribromo-3-hydroxy-benzoic acid,2,4,6-tribromo-3-hydroxybenzoic acid
IUPAC Name 2,4,6-tribromo-3-hydroxybenzoic acid
InChI Key YDBHVMTTYXWHLI-UHFFFAOYSA-N
Molecular Formula C7H3Br3O3
5,984

3,4-Diaminobenzoic acid, 94%

CAS: 619-05-6 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 MDL Number: MFCD00007726 InChI Key: HEMGYNNCNNODNX-UHFFFAOYSA-N Synonym: benzoic acid, 3,4-diamino,4-carboxyphenyldiamine,3,4-diamino benzoic acid,4-carboxy-o-phenylenediamine,3,4-diaminobenzoicacid,acmc-209mxf,3,4-diaminobenzoesaeure,3,4 diaminobenzoic acid,3,4-diaminobenzenoic acid,3,4-diamino-benzoic acid PubChem CID: 69263 IUPAC Name: 3,4-diaminobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)N)N

PubChem CID 69263
CAS 619-05-6
Molecular Weight (g/mol) 152.153
MDL Number MFCD00007726
SMILES C1=CC(=C(C=C1C(=O)O)N)N
Synonym benzoic acid, 3,4-diamino,4-carboxyphenyldiamine,3,4-diamino benzoic acid,4-carboxy-o-phenylenediamine,3,4-diaminobenzoicacid,acmc-209mxf,3,4-diaminobenzoesaeure,3,4 diaminobenzoic acid,3,4-diaminobenzenoic acid,3,4-diamino-benzoic acid
IUPAC Name 3,4-diaminobenzoic acid
InChI Key HEMGYNNCNNODNX-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
5,985

3-Chloro-4-fluorothiobenzamide, 97%

CAS: 130560-97-3 Molecular Formula: C7H5ClFNS Molecular Weight (g/mol): 189.632 MDL Number: MFCD00042478 InChI Key: RSGPCKCTKDCMRR-UHFFFAOYSA-N Synonym: 3-chloro-4-fluorothiobenzamide,3-chloro-4-fluorobenzothioamide,3-chloro-4-fluorobenzene-1-carbothioamide,benzenecarbothioamide,3-chloro-4-fluoro,amino 3-chloro-4-fluorophenyl methane-1-thione,acmc-1ccr0,3-chloro-4-fluoro-thiobenzamide,#,3-chloranyl-4-fluoranyl-benzenecarbothioamide,benzenecarbothioamide, 3-chloro-4-fluoro-9ci PubChem CID: 2779521 IUPAC Name: 3-chloro-4-fluorobenzenecarbothioamide SMILES: C1=CC(=C(C=C1C(=S)N)Cl)F

PubChem CID 2779521
CAS 130560-97-3
Molecular Weight (g/mol) 189.632
MDL Number MFCD00042478
SMILES C1=CC(=C(C=C1C(=S)N)Cl)F
Synonym 3-chloro-4-fluorothiobenzamide,3-chloro-4-fluorobenzothioamide,3-chloro-4-fluorobenzene-1-carbothioamide,benzenecarbothioamide,3-chloro-4-fluoro,amino 3-chloro-4-fluorophenyl methane-1-thione,acmc-1ccr0,3-chloro-4-fluoro-thiobenzamide,#,3-chloranyl-4-fluoranyl-benzenecarbothioamide,benzenecarbothioamide, 3-chloro-4-fluoro-9ci
IUPAC Name 3-chloro-4-fluorobenzenecarbothioamide
InChI Key RSGPCKCTKDCMRR-UHFFFAOYSA-N
Molecular Formula C7H5ClFNS