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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 (67,607)
Phenols (13,420)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (557)
Anthracenes (412)
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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1,126 – 1,140 of 78,418 results
1,126

2,4-Dihydroxybenzoic acid, 97%

CAS: 89-86-1 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002451 InChI Key: UIAFKZKHHVMJGS-UHFFFAOYSA-N Synonym: beta-resorcylic acid,p-hydroxysalicylic acid,4-carboxyresorcinol,4-hydroxysalicylic acid,benzoic acid, 2,4-dihydroxy,beta-resorcinolic acid,2,4-dhba,resorcylic acid, beta,b-resorcylic acid,2,4-dihydroxy-benzoic acid PubChem CID: 1491 IUPAC Name: 2,4-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1O)O)C(=O)O

PubChem CID 1491
CAS 89-86-1
Molecular Weight (g/mol) 154.12
MDL Number MFCD00002451
SMILES C1=CC(=C(C=C1O)O)C(=O)O
Synonym beta-resorcylic acid,p-hydroxysalicylic acid,4-carboxyresorcinol,4-hydroxysalicylic acid,benzoic acid, 2,4-dihydroxy,beta-resorcinolic acid,2,4-dhba,resorcylic acid, beta,b-resorcylic acid,2,4-dihydroxy-benzoic acid
IUPAC Name 2,4-dihydroxybenzoic acid
InChI Key UIAFKZKHHVMJGS-UHFFFAOYSA-N
Molecular Formula C7H6O4
1,127

Methyl 1-hydroxy-2-naphthoate

CAS: 948-03-8 Molecular Formula: C12H10O3 Molecular Weight (g/mol): 202.21 InChI Key: HMIBDRSTVGFJPB-UHFFFAOYSA-N Synonym: methyl 1-hydroxy-2-naphthoate,2-naphthalenecarboxylic acid, 1-hydroxy-, methyl ester,1-hydroxy-2-naphthoic acid methyl ester,1-hydroxy-2-naphthoic acid, methyl ester,acmc-20akjf,2-naphthoic acid, 1-hydroxy-, methyl ester,methyl=1-hydroxy-2-naphthoate,1-hydroxy-2-carbomethoxynaphthalene,methyl 1-hydroxy-naphthalene-2-carboxylate PubChem CID: 70358 IUPAC Name: methyl 1-hydroxynaphthalene-2-carboxylate SMILES: COC(=O)C1=C(C2=CC=CC=C2C=C1)O

PubChem CID 70358
CAS 948-03-8
Molecular Weight (g/mol) 202.21
SMILES COC(=O)C1=C(C2=CC=CC=C2C=C1)O
Synonym methyl 1-hydroxy-2-naphthoate,2-naphthalenecarboxylic acid, 1-hydroxy-, methyl ester,1-hydroxy-2-naphthoic acid methyl ester,1-hydroxy-2-naphthoic acid, methyl ester,acmc-20akjf,2-naphthoic acid, 1-hydroxy-, methyl ester,methyl=1-hydroxy-2-naphthoate,1-hydroxy-2-carbomethoxynaphthalene,methyl 1-hydroxy-naphthalene-2-carboxylate
IUPAC Name methyl 1-hydroxynaphthalene-2-carboxylate
InChI Key HMIBDRSTVGFJPB-UHFFFAOYSA-N
Molecular Formula C12H10O3
1,128

2-Bromo-4-chloro-1-iodobenzene, 98%

CAS: 31928-44-6 Molecular Formula: C6H3BrClI Molecular Weight (g/mol): 317.348 MDL Number: MFCD00672944 InChI Key: CXHXFDQEFKFYQJ-UHFFFAOYSA-N Synonym: 2-bromo-4-chloroiodobenzene,benzene, 2-bromo-4-chloro-1-iodo,acmc-209hpo,ksc494q6f,1-iodo-2-bromo-4-chlorobenzene,2-bromo-1-iodo-4-chlorobenzene PubChem CID: 13741326 IUPAC Name: 2-bromo-4-chloro-1-iodobenzene SMILES: C1=CC(=C(C=C1Cl)Br)I

PubChem CID 13741326
CAS 31928-44-6
Molecular Weight (g/mol) 317.348
MDL Number MFCD00672944
SMILES C1=CC(=C(C=C1Cl)Br)I
Synonym 2-bromo-4-chloroiodobenzene,benzene, 2-bromo-4-chloro-1-iodo,acmc-209hpo,ksc494q6f,1-iodo-2-bromo-4-chlorobenzene,2-bromo-1-iodo-4-chlorobenzene
IUPAC Name 2-bromo-4-chloro-1-iodobenzene
InChI Key CXHXFDQEFKFYQJ-UHFFFAOYSA-N
Molecular Formula C6H3BrClI
1,129

2-Fluoro-3-methylbenzoic acid, 98%

CAS: 315-31-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00042504 InChI Key: DGNAETGARNTCIL-UHFFFAOYSA-N Synonym: 2-fluoro-m-toluic acid,2-fluoro-3-methylbenzoicacid,benzoic acid, 2-fluoro-3-methyl,2-fluoro-3-methyl-benzoic acid,maybridge1_003142,pubchem1328,fluoro-3-methylbenzoic acid,ksc222a8b,3-methyl-2-fluorobenzoic acid,2-fluoro-3-methyl benzoic acid PubChem CID: 2737379 IUPAC Name: 2-fluoro-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1F

PubChem CID 2737379
CAS 315-31-1
Molecular Weight (g/mol) 154.14
MDL Number MFCD00042504
SMILES CC1=CC=CC(C(O)=O)=C1F
Synonym 2-fluoro-m-toluic acid,2-fluoro-3-methylbenzoicacid,benzoic acid, 2-fluoro-3-methyl,2-fluoro-3-methyl-benzoic acid,maybridge1_003142,pubchem1328,fluoro-3-methylbenzoic acid,ksc222a8b,3-methyl-2-fluorobenzoic acid,2-fluoro-3-methyl benzoic acid
IUPAC Name 2-fluoro-3-methylbenzoic acid
InChI Key DGNAETGARNTCIL-UHFFFAOYSA-N
Molecular Formula C8H7FO2
1,130

3-Fluoro-4-methoxyaniline, 98+%

CAS: 366-99-4 Molecular Formula: C7H8FNO Molecular Weight (g/mol): 141.145 MDL Number: MFCD00075040 InChI Key: LJWAPDSCYTZUJU-UHFFFAOYSA-N Synonym: 3-fluoro-4-anisidine,4-amino-2-fluoroanisole,3-fluoro-p-anisidine,3-fluoro-4-methoxy-phenylamine,benzenamine, 3-fluoro-4-methoxy,3-fluoro-4-methoxy-aniline,3-fluoro-4-methoxyphenylamine,2-fluoro-4-aminoanisole,3-fluoro-4-methoxy-anilin,3-fluoro-4-methoxy-benzenamine PubChem CID: 581110 IUPAC Name: 3-fluoro-4-methoxyaniline SMILES: COC1=C(C=C(C=C1)N)F

PubChem CID 581110
CAS 366-99-4
Molecular Weight (g/mol) 141.145
MDL Number MFCD00075040
SMILES COC1=C(C=C(C=C1)N)F
Synonym 3-fluoro-4-anisidine,4-amino-2-fluoroanisole,3-fluoro-p-anisidine,3-fluoro-4-methoxy-phenylamine,benzenamine, 3-fluoro-4-methoxy,3-fluoro-4-methoxy-aniline,3-fluoro-4-methoxyphenylamine,2-fluoro-4-aminoanisole,3-fluoro-4-methoxy-anilin,3-fluoro-4-methoxy-benzenamine
IUPAC Name 3-fluoro-4-methoxyaniline
InChI Key LJWAPDSCYTZUJU-UHFFFAOYSA-N
Molecular Formula C7H8FNO
1,131

3-Ethoxy-4-methoxybenzoic acid, 98%

CAS: 2651-55-0 Molecular Formula: C10H11O4 Molecular Weight (g/mol): 195.20 MDL Number: MFCD00276591 InChI Key: DMSAIFTWQMXOBE-UHFFFAOYSA-M Synonym: benzoic acid,3-ethoxy-4-methoxy,maybridge1_005010,3-ethoxy-4-methoxybenzoicacid,acmc-1cqm3 PubChem CID: 2822957 IUPAC Name: 3-ethoxy-4-methoxybenzoic acid SMILES: CCOC1=CC(=CC=C1OC)C([O-])=O

PubChem CID 2822957
CAS 2651-55-0
Molecular Weight (g/mol) 195.20
MDL Number MFCD00276591
SMILES CCOC1=CC(=CC=C1OC)C([O-])=O
Synonym benzoic acid,3-ethoxy-4-methoxy,maybridge1_005010,3-ethoxy-4-methoxybenzoicacid,acmc-1cqm3
IUPAC Name 3-ethoxy-4-methoxybenzoic acid
InChI Key DMSAIFTWQMXOBE-UHFFFAOYSA-M
Molecular Formula C10H11O4
1,132

7-Bromo-1-tetralone, 97%

CAS: 32281-97-3 Molecular Formula: C10H9BrO Molecular Weight (g/mol): 225.085 MDL Number: MFCD02179287 InChI Key: YGVDCGFUUUJCDF-UHFFFAOYSA-N Synonym: 7-bromo-1-tetralone,7-bromo-3,4-dihydronaphthalen-1 2h-one,7-bromo-3,4-dihydro-1 2h-naphthalenone,7-bromotetralone,7-bromo-alpha-tetralone,7-bromotetralin-1-one,7-bromo-1,2,3,4-tetrahydronaphthalen-1-one,7-bromo-2,3,4-trihydronaphthalen-1-one,1 2h-naphthalenone, 7-bromo-3,4-dihydro,7-bromo tetralone PubChem CID: 252731 IUPAC Name: 7-bromo-3,4-dihydro-2H-naphthalen-1-one SMILES: C1CC2=C(C=C(C=C2)Br)C(=O)C1

PubChem CID 252731
CAS 32281-97-3
Molecular Weight (g/mol) 225.085
MDL Number MFCD02179287
SMILES C1CC2=C(C=C(C=C2)Br)C(=O)C1
Synonym 7-bromo-1-tetralone,7-bromo-3,4-dihydronaphthalen-1 2h-one,7-bromo-3,4-dihydro-1 2h-naphthalenone,7-bromotetralone,7-bromo-alpha-tetralone,7-bromotetralin-1-one,7-bromo-1,2,3,4-tetrahydronaphthalen-1-one,7-bromo-2,3,4-trihydronaphthalen-1-one,1 2h-naphthalenone, 7-bromo-3,4-dihydro,7-bromo tetralone
IUPAC Name 7-bromo-3,4-dihydro-2H-naphthalen-1-one
InChI Key YGVDCGFUUUJCDF-UHFFFAOYSA-N
Molecular Formula C10H9BrO
1,133

4-Fluoro-alpha-toluenesulfonyl chloride, 97%

CAS: 103360-04-9 Molecular Formula: C7H6ClFO2S Molecular Weight (g/mol): 208.631 MDL Number: MFCD01631930 InChI Key: UUQGWVIRPCRTSA-UHFFFAOYSA-N Synonym: 4-fluorophenyl methanesulfonyl chloride,4-fluorobenzylsulfonyl chloride,4-fluoro-phenyl-methanesulfonyl chloride,4-fluorophenyl methyl sulfonyl chloride,chloro 4-fluorophenyl methyl sulfone,4-fluorophenyl methanesulphonyl chloride,4-fluoro-alpha-toluenesulfonyl chloride,benzenemethanesulfonyl chloride, 4-fluoro,4-fluoro-phenyl-methane sulfonyl chloride,pubchem10056 PubChem CID: 2759108 IUPAC Name: (4-fluorophenyl)methanesulfonyl chloride SMILES: C1=CC(=CC=C1CS(=O)(=O)Cl)F

PubChem CID 2759108
CAS 103360-04-9
Molecular Weight (g/mol) 208.631
MDL Number MFCD01631930
SMILES C1=CC(=CC=C1CS(=O)(=O)Cl)F
Synonym 4-fluorophenyl methanesulfonyl chloride,4-fluorobenzylsulfonyl chloride,4-fluoro-phenyl-methanesulfonyl chloride,4-fluorophenyl methyl sulfonyl chloride,chloro 4-fluorophenyl methyl sulfone,4-fluorophenyl methanesulphonyl chloride,4-fluoro-alpha-toluenesulfonyl chloride,benzenemethanesulfonyl chloride, 4-fluoro,4-fluoro-phenyl-methane sulfonyl chloride,pubchem10056
IUPAC Name (4-fluorophenyl)methanesulfonyl chloride
InChI Key UUQGWVIRPCRTSA-UHFFFAOYSA-N
Molecular Formula C7H6ClFO2S
1,134

1-Bromo-3-ethylbenzene, 98%

CAS: 2725-82-8 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00156128 InChI Key: ZRFJYAZQMFCUIX-UHFFFAOYSA-N Synonym: benzene, 1-bromo-3-ethyl,3-ethylbromobenzene,1-bromo-3-ethyl-benzene,3-bromoethyl benzene,3ethylbromobenzene,m-bromoethylbenzene,3-bromo-ethylbenzene,pubchem3771,1bromo-3-ethylbenzene,1-bromo-3-ethylbenze PubChem CID: 123170 IUPAC Name: 1-bromo-3-ethylbenzene SMILES: CCC1=CC(=CC=C1)Br

PubChem CID 123170
CAS 2725-82-8
Molecular Weight (g/mol) 185.064
MDL Number MFCD00156128
SMILES CCC1=CC(=CC=C1)Br
Synonym benzene, 1-bromo-3-ethyl,3-ethylbromobenzene,1-bromo-3-ethyl-benzene,3-bromoethyl benzene,3ethylbromobenzene,m-bromoethylbenzene,3-bromo-ethylbenzene,pubchem3771,1bromo-3-ethylbenzene,1-bromo-3-ethylbenze
IUPAC Name 1-bromo-3-ethylbenzene
InChI Key ZRFJYAZQMFCUIX-UHFFFAOYSA-N
Molecular Formula C8H9Br
1,135

2-Cyano-4-(trifluoromethyl)benzeneboronic acid, 95%

CAS: 1218790-84-1 Molecular Formula: C8H5BF3NO2 Molecular Weight (g/mol): 214.938 InChI Key: DELAZGQTKSRLPA-UHFFFAOYSA-N Synonym: 2-cyano-4-trifluoromethyl phenylboronic acid,2-cyano-4-trifluoromethyl phenyl boronic acid,acmc-209ail,2-cyano-4-trifluoromethyl phenyl boronicacid PubChem CID: 53216599 IUPAC Name: [2-cyano-4-(trifluoromethyl)phenyl]boronic acid SMILES: B(C1=C(C=C(C=C1)C(F)(F)F)C#N)(O)O

PubChem CID 53216599
CAS 1218790-84-1
Molecular Weight (g/mol) 214.938
SMILES B(C1=C(C=C(C=C1)C(F)(F)F)C#N)(O)O
Synonym 2-cyano-4-trifluoromethyl phenylboronic acid,2-cyano-4-trifluoromethyl phenyl boronic acid,acmc-209ail,2-cyano-4-trifluoromethyl phenyl boronicacid
IUPAC Name [2-cyano-4-(trifluoromethyl)phenyl]boronic acid
InChI Key DELAZGQTKSRLPA-UHFFFAOYSA-N
Molecular Formula C8H5BF3NO2
1,136

3-Bromo-2,6-dimethoxybenzoic acid, ≥97%, Thermo Scientific™

CAS: 73219-89-3 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.071 MDL Number: MFCD00052933 InChI Key: CUQANLQRQJHIQE-UHFFFAOYSA-N PubChem CID: 2774744 IUPAC Name: 3-bromo-2,6-dimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)Br)OC)C(=O)O

PubChem CID 2774744
CAS 73219-89-3
Molecular Weight (g/mol) 261.071
MDL Number MFCD00052933
SMILES COC1=C(C(=C(C=C1)Br)OC)C(=O)O
IUPAC Name 3-bromo-2,6-dimethoxybenzoic acid
InChI Key CUQANLQRQJHIQE-UHFFFAOYSA-N
Molecular Formula C9H9BrO4
1,137

1-(3-Bromobenzyl)-1H-imidazole, ≥97%, Thermo Scientific™

CAS: 72459-47-3 Molecular Formula: C10H9BrN2 Molecular Weight (g/mol): 237.10 MDL Number: MFCD08271919 InChI Key: BGYZLOIBJCHCTI-UHFFFAOYSA-N Synonym: 1-3-bromobenzyl-1h-imidazole,1-3-bromophenyl methyl imidazole,1-3-bromobenzyl imidazole,1-3-bromophenyl methyl-1h-imidazole,1h-imidazole,1-3-bromophenyl methyl,d07jmo,3-bromophenyl methyl imidazole PubChem CID: 10220337 IUPAC Name: 1-[(3-bromophenyl)methyl]imidazole SMILES: BrC1=CC=CC(CN2C=CN=C2)=C1

PubChem CID 10220337
CAS 72459-47-3
Molecular Weight (g/mol) 237.10
MDL Number MFCD08271919
SMILES BrC1=CC=CC(CN2C=CN=C2)=C1
Synonym 1-3-bromobenzyl-1h-imidazole,1-3-bromophenyl methyl imidazole,1-3-bromobenzyl imidazole,1-3-bromophenyl methyl-1h-imidazole,1h-imidazole,1-3-bromophenyl methyl,d07jmo,3-bromophenyl methyl imidazole
IUPAC Name 1-[(3-bromophenyl)methyl]imidazole
InChI Key BGYZLOIBJCHCTI-UHFFFAOYSA-N
Molecular Formula C10H9BrN2
1,138

2-Chloro-4-(dimethylamino)benzaldehyde, ≥95%, Thermo Scientific™

CAS: 1424-66-4 Molecular Formula: C9H10ClNO Molecular Weight (g/mol): 183.64 MDL Number: MFCD00021051 InChI Key: XSQFAWMDRFSIMY-UHFFFAOYSA-N Synonym: 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline PubChem CID: 74021 IUPAC Name: 2-chloro-4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C(Cl)=C1

PubChem CID 74021
CAS 1424-66-4
Molecular Weight (g/mol) 183.64
MDL Number MFCD00021051
SMILES CN(C)C1=CC=C(C=O)C(Cl)=C1
Synonym 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline
IUPAC Name 2-chloro-4-(dimethylamino)benzaldehyde
InChI Key XSQFAWMDRFSIMY-UHFFFAOYSA-N
Molecular Formula C9H10ClNO
1,139

Methyl 2-amino-5-bromobenzoate, 98%

CAS: 52727-57-8 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.06 MDL Number: MFCD00144761 InChI Key: QVNYNHCNNGKULA-UHFFFAOYSA-N Synonym: methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7 PubChem CID: 736224 IUPAC Name: methyl 2-amino-5-bromobenzoate SMILES: COC(=O)C1=CC(Br)=CC=C1N

PubChem CID 736224
CAS 52727-57-8
Molecular Weight (g/mol) 230.06
MDL Number MFCD00144761
SMILES COC(=O)C1=CC(Br)=CC=C1N
Synonym methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7
IUPAC Name methyl 2-amino-5-bromobenzoate
InChI Key QVNYNHCNNGKULA-UHFFFAOYSA-N
Molecular Formula C8H8BrNO2
1,140

Benzyltriethylammonium chloride, 98%

CAS: 56-37-1 Molecular Formula: C13H22ClN Molecular Weight (g/mol): 227.78 MDL Number: MFCD00011824 InChI Key: HTZCNXWZYVXIMZ-UHFFFAOYSA-M Synonym: benzyltriethylammonium chloride,tebac,benzyl triethylammonium chloride,benzyl triethyl ammonium chloride,benzyltriethylammoniumchloride,triethylbenzylammonium chloride,bteac,teba,benzyltriethylazanium chloride,n-benzyl-n,n-diethylethanaminium chloride PubChem CID: 66133 IUPAC Name: benzyl(triethyl)azanium;chloride SMILES: [Cl-].CC[N+](CC)(CC)CC1=CC=CC=C1

PubChem CID 66133
CAS 56-37-1
Molecular Weight (g/mol) 227.78
MDL Number MFCD00011824
SMILES [Cl-].CC[N+](CC)(CC)CC1=CC=CC=C1
Synonym benzyltriethylammonium chloride,tebac,benzyl triethylammonium chloride,benzyl triethyl ammonium chloride,benzyltriethylammoniumchloride,triethylbenzylammonium chloride,bteac,teba,benzyltriethylazanium chloride,n-benzyl-n,n-diethylethanaminium chloride
IUPAC Name benzyl(triethyl)azanium;chloride
InChI Key HTZCNXWZYVXIMZ-UHFFFAOYSA-M
Molecular Formula C13H22ClN