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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 (67,704)
Phenols (13,502)
Naphthalenes (5,073)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (564)
Anthracenes (413)
Phenanthrenes and derivatives (327)
Tetralins (327)
Indanes (313)
Triphenyl compounds (278)
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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3,211 – 3,225 of 78,615 results
3,211

4-Fluoro-2-iodobenzoic acid, 97%

CAS: 56096-89-0 Molecular Formula: C7H4FIO2 Molecular Weight (g/mol): 266.01 MDL Number: MFCD04108278 InChI Key: DUKFTVLJAXWGPI-UHFFFAOYSA-N Synonym: 4-fluoro-2-iodo-benzoic acid,2-iodo-4-fluorobenzoic acid,4-fluoro-2-iodobenzoicacid,benzoic acid, 4-fluoro-2-iodo,benzoic acid, 4-fluoroiodo,pubchem1389,acmc-1atr7,ksc494a9j,benzoic acid,4-fluoro-2-iodo,buttpark 83\07-33 PubChem CID: 12520164 IUPAC Name: 4-fluoro-2-iodobenzoic acid SMILES: C1=CC(=C(C=C1F)I)C(=O)O

PubChem CID 12520164
CAS 56096-89-0
Molecular Weight (g/mol) 266.01
MDL Number MFCD04108278
SMILES C1=CC(=C(C=C1F)I)C(=O)O
Synonym 4-fluoro-2-iodo-benzoic acid,2-iodo-4-fluorobenzoic acid,4-fluoro-2-iodobenzoicacid,benzoic acid, 4-fluoro-2-iodo,benzoic acid, 4-fluoroiodo,pubchem1389,acmc-1atr7,ksc494a9j,benzoic acid,4-fluoro-2-iodo,buttpark 83\07-33
IUPAC Name 4-fluoro-2-iodobenzoic acid
InChI Key DUKFTVLJAXWGPI-UHFFFAOYSA-N
Molecular Formula C7H4FIO2
3,212

Ethyl o-toluate, 98+%

CAS: 87-24-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00009112 InChI Key: SOUAXOGPALPTTC-UHFFFAOYSA-N Synonym: ethyl o-toluate,ethyl o-methylbenzoate,ethyl orthotoluate,2-methylbenzoic acid ethyl ester,benzoic acid, 2-methyl-, ethyl ester,ethyl-o-toluate,2-methyl-benzoic acid ethyl ester,o-toluic acid ethyl ester,ethyl-2-methylbenzoate,ethylo-toluate PubChem CID: 66598 IUPAC Name: ethyl 2-methylbenzoate SMILES: CCOC(=O)C1=CC=CC=C1C

PubChem CID 66598
CAS 87-24-1
Molecular Weight (g/mol) 164.204
MDL Number MFCD00009112
SMILES CCOC(=O)C1=CC=CC=C1C
Synonym ethyl o-toluate,ethyl o-methylbenzoate,ethyl orthotoluate,2-methylbenzoic acid ethyl ester,benzoic acid, 2-methyl-, ethyl ester,ethyl-o-toluate,2-methyl-benzoic acid ethyl ester,o-toluic acid ethyl ester,ethyl-2-methylbenzoate,ethylo-toluate
IUPAC Name ethyl 2-methylbenzoate
InChI Key SOUAXOGPALPTTC-UHFFFAOYSA-N
Molecular Formula C10H12O2
3,213

4-(Cyanomethyl)benzeneboronic acid, 95%

CAS: 91983-26-5 Molecular Formula: C8H8BNO2 Molecular Weight (g/mol): 160.967 MDL Number: MFCD01632200 InChI Key: YKVMTTIYBSVPEQ-UHFFFAOYSA-N Synonym: 4-cyanomethyl benzeneboronic acid,4-cyanomethyl phenyl boronic acid,4-cyanomethylphenylboronic acid,4-cyanomethylphenyl boronic acid,4-cyanomethyl phenylboronic acid,4-boronophenylacetonitrile,boronic acid, 4-cyanomethyl phenyl,pubchem7789,acmc-209ree PubChem CID: 2773342 IUPAC Name: [4-(cyanomethyl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)CC#N)(O)O

PubChem CID 2773342
CAS 91983-26-5
Molecular Weight (g/mol) 160.967
MDL Number MFCD01632200
SMILES B(C1=CC=C(C=C1)CC#N)(O)O
Synonym 4-cyanomethyl benzeneboronic acid,4-cyanomethyl phenyl boronic acid,4-cyanomethylphenylboronic acid,4-cyanomethylphenyl boronic acid,4-cyanomethyl phenylboronic acid,4-boronophenylacetonitrile,boronic acid, 4-cyanomethyl phenyl,pubchem7789,acmc-209ree
IUPAC Name [4-(cyanomethyl)phenyl]boronic acid
InChI Key YKVMTTIYBSVPEQ-UHFFFAOYSA-N
Molecular Formula C8H8BNO2
3,214

2,6-Dibromo-4-isopropylaniline, 98%

CAS: 10546-65-3 Molecular Formula: C9H11Br2N Molecular Weight (g/mol): 293.002 MDL Number: MFCD00015475 InChI Key: CJEBZUFROMNDEK-UHFFFAOYSA-N PubChem CID: 139184 IUPAC Name: 2,6-dibromo-4-propan-2-ylaniline SMILES: CC(C)C1=CC(=C(C(=C1)Br)N)Br

PubChem CID 139184
CAS 10546-65-3
Molecular Weight (g/mol) 293.002
MDL Number MFCD00015475
SMILES CC(C)C1=CC(=C(C(=C1)Br)N)Br
IUPAC Name 2,6-dibromo-4-propan-2-ylaniline
InChI Key CJEBZUFROMNDEK-UHFFFAOYSA-N
Molecular Formula C9H11Br2N
3,215

2-Chloro-4-methoxyphenol, 97%

CAS: 18113-03-6 Molecular Formula: C7H7ClO2 Molecular Weight (g/mol): 158.581 MDL Number: MFCD00070773 InChI Key: GNVRRKLFFYSLGT-UHFFFAOYSA-N PubChem CID: 87459 IUPAC Name: 2-chloro-4-methoxyphenol SMILES: COC1=CC(=C(C=C1)O)Cl

PubChem CID 87459
CAS 18113-03-6
Molecular Weight (g/mol) 158.581
MDL Number MFCD00070773
SMILES COC1=CC(=C(C=C1)O)Cl
IUPAC Name 2-chloro-4-methoxyphenol
InChI Key GNVRRKLFFYSLGT-UHFFFAOYSA-N
Molecular Formula C7H7ClO2
3,216

2,4-Dibromophenol, 98%

CAS: 615-58-7 Molecular Formula: C6H4Br2O Molecular Weight (g/mol): 251.905 MDL Number: MFCD00002149 InChI Key: FAXWFCTVSHEODL-UHFFFAOYSA-N Synonym: phenol, 2,4-dibromo,2,4-dibromo-phenol,2,4-dibromphenol,unii-ia75t5c9tg,2,4-bis bromanyl phenol,ia75t5c9tg,phenol,4-dibromo,emery 9331,acmc-1bga9,2,4-dibromophenol PubChem CID: 12005 ChEBI: CHEBI:34238 IUPAC Name: 2,4-dibromophenol SMILES: C1=CC(=C(C=C1Br)Br)O

PubChem CID 12005
CAS 615-58-7
Molecular Weight (g/mol) 251.905
ChEBI CHEBI:34238
MDL Number MFCD00002149
SMILES C1=CC(=C(C=C1Br)Br)O
Synonym phenol, 2,4-dibromo,2,4-dibromo-phenol,2,4-dibromphenol,unii-ia75t5c9tg,2,4-bis bromanyl phenol,ia75t5c9tg,phenol,4-dibromo,emery 9331,acmc-1bga9,2,4-dibromophenol
IUPAC Name 2,4-dibromophenol
InChI Key FAXWFCTVSHEODL-UHFFFAOYSA-N
Molecular Formula C6H4Br2O
3,217

alpha'-Bromo-alpha,alpha,alpha-trifluoro-p-xylene, 98%

CAS: 402-49-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00000403 InChI Key: IKSNDOVDVVPSMA-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene PubChem CID: 123062 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1CBr)C(F)(F)F

PubChem CID 123062
CAS 402-49-3
Molecular Weight (g/mol) 239.04
MDL Number MFCD00000403
SMILES C1=CC(=CC=C1CBr)C(F)(F)F
Synonym 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene
IUPAC Name 1-(bromomethyl)-4-(trifluoromethyl)benzene
InChI Key IKSNDOVDVVPSMA-UHFFFAOYSA-N
Molecular Formula C8H6BrF3
3,218

4-Bromobenzamide, 97%, Thermo Scientific™

CAS: 698-67-9 Molecular Formula: C7H6BrNO Molecular Weight (g/mol): 200.03 MDL Number: MFCD00007991 InChI Key: ZRWNRAJCPNLYAK-UHFFFAOYSA-N Synonym: p-bromobenzamide,benzamide, 4-bromo,benzamide, p-bromo,p-bromobenzoic acid amide,4-bromo-benzamide,4-bromo benzamide,pubchem3737,acmc-209obe,4-bromobenzamide,4-bromobenzoic acid amide PubChem CID: 69683 IUPAC Name: 4-bromobenzamide SMILES: C1=CC(=CC=C1C(=O)N)Br

PubChem CID 69683
CAS 698-67-9
Molecular Weight (g/mol) 200.03
MDL Number MFCD00007991
SMILES C1=CC(=CC=C1C(=O)N)Br
Synonym p-bromobenzamide,benzamide, 4-bromo,benzamide, p-bromo,p-bromobenzoic acid amide,4-bromo-benzamide,4-bromo benzamide,pubchem3737,acmc-209obe,4-bromobenzamide,4-bromobenzoic acid amide
IUPAC Name 4-bromobenzamide
InChI Key ZRWNRAJCPNLYAK-UHFFFAOYSA-N
Molecular Formula C7H6BrNO
3,219

4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione, 99%

CAS: 893-33-4 Molecular Formula: C14H9F3O2 Molecular Weight (g/mol): 266.219 MDL Number: MFCD00054501 InChI Key: WVVLURYIQCXPIV-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-naphthalen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-naphthyl-1,3-butanedione,1-2-naphthoyl-3,3,3-trifluoroacetone,4,4,4-trifluoro-1-2-naphthyl butane-1,3-dione,3-2-naphthoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthalenyl,2-naphthoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthyl,4,4,4-trifluoro-3-oxo-2'-butyronaphthone,acmc-1bl5t PubChem CID: 70179 IUPAC Name: 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F

PubChem CID 70179
CAS 893-33-4
Molecular Weight (g/mol) 266.219
MDL Number MFCD00054501
SMILES C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F
Synonym 4,4,4-trifluoro-1-naphthalen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-naphthyl-1,3-butanedione,1-2-naphthoyl-3,3,3-trifluoroacetone,4,4,4-trifluoro-1-2-naphthyl butane-1,3-dione,3-2-naphthoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthalenyl,2-naphthoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthyl,4,4,4-trifluoro-3-oxo-2'-butyronaphthone,acmc-1bl5t
IUPAC Name 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione
InChI Key WVVLURYIQCXPIV-UHFFFAOYSA-N
Molecular Formula C14H9F3O2
3,220

trans-Dichlorobis(triphenylphosphine)palladium(II), Pd 14.0% min

CAS: 13965-03-2 Molecular Formula: C36H30Cl2P2Pd Molecular Weight (g/mol): 701.90 MDL Number: MFCD00009593 InChI Key: YNHIGQDRGKUECZ-UHFFFAOYSA-L Synonym: bis triphenylphosphine palladium ii dichloride,bis triphenylphosphine palladium ii chloride,dichlorobis triphenylphosphine palladium,bis triphenylphosphine palladium chloride,bis triphenylphosphine palladiuml ii dichloride,palladium 2+ ; triphenylphosphane; dichloride,trans-dichlorobis triphenylphosphine palladium ii 1g PubChem CID: 131664180 IUPAC Name: ethane;methane;palladium(2+);triphenylphosphane;dichloride SMILES: [Cl-].[Cl-].[Pd++].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 131664180
CAS 13965-03-2
Molecular Weight (g/mol) 701.90
MDL Number MFCD00009593
SMILES [Cl-].[Cl-].[Pd++].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym bis triphenylphosphine palladium ii dichloride,bis triphenylphosphine palladium ii chloride,dichlorobis triphenylphosphine palladium,bis triphenylphosphine palladium chloride,bis triphenylphosphine palladiuml ii dichloride,palladium 2+ ; triphenylphosphane; dichloride,trans-dichlorobis triphenylphosphine palladium ii 1g
IUPAC Name ethane;methane;palladium(2+);triphenylphosphane;dichloride
InChI Key YNHIGQDRGKUECZ-UHFFFAOYSA-L
Molecular Formula C36H30Cl2P2Pd
3,221

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
3,222

4-Aminophenyl sulfone, 97%

CAS: 80-08-0 Molecular Formula: C12H12N2O2S Molecular Weight (g/mol): 248.3 MDL Number: MFCD00007887 InChI Key: MQJKPEGWNLWLTK-UHFFFAOYSA-N Synonym: dapsone,diaphenylsulfone,4,4'-diaminodiphenyl sulfone,dapson,4,4'-sulfonyldianiline,diaphenylsulfon,sulfona,4-aminophenyl sulfone,avlosulfone,diphenasone PubChem CID: 2955 ChEBI: CHEBI:4325 IUPAC Name: 4-(4-aminophenyl)sulfonylaniline SMILES: C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N

PubChem CID 2955
CAS 80-08-0
Molecular Weight (g/mol) 248.3
ChEBI CHEBI:4325
MDL Number MFCD00007887
SMILES C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N
Synonym dapsone,diaphenylsulfone,4,4'-diaminodiphenyl sulfone,dapson,4,4'-sulfonyldianiline,diaphenylsulfon,sulfona,4-aminophenyl sulfone,avlosulfone,diphenasone
IUPAC Name 4-(4-aminophenyl)sulfonylaniline
InChI Key MQJKPEGWNLWLTK-UHFFFAOYSA-N
Molecular Formula C12H12N2O2S
3,223

5-Amino-2-methylbenzonitrile, 97%, Thermo Scientific Chemicals

CAS: 50670-64-9 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.166 MDL Number: MFCD00017608 InChI Key: YDZVQWCVKXYGIU-UHFFFAOYSA-N Synonym: 5-amino-2-methylbenzenecarbonitrile,2-methyl-5-aminobenzonitrile,4-amino-2-cyanotoluene,3-cyano-4-methylaniline,5-amino-2-methyl-benzonitrile,benzonitrile, 5-amino-2-methyl,5-amino-o-tolunitrile,acmc-20a01k,aminomethylbenzenecarbonitrile,3-amino-6-methylbenzonitrile PubChem CID: 2735365 IUPAC Name: 5-amino-2-methylbenzonitrile SMILES: CC1=C(C=C(C=C1)N)C#N

PubChem CID 2735365
CAS 50670-64-9
Molecular Weight (g/mol) 132.166
MDL Number MFCD00017608
SMILES CC1=C(C=C(C=C1)N)C#N
Synonym 5-amino-2-methylbenzenecarbonitrile,2-methyl-5-aminobenzonitrile,4-amino-2-cyanotoluene,3-cyano-4-methylaniline,5-amino-2-methyl-benzonitrile,benzonitrile, 5-amino-2-methyl,5-amino-o-tolunitrile,acmc-20a01k,aminomethylbenzenecarbonitrile,3-amino-6-methylbenzonitrile
IUPAC Name 5-amino-2-methylbenzonitrile
InChI Key YDZVQWCVKXYGIU-UHFFFAOYSA-N
Molecular Formula C8H8N2
3,224

2-Chlorophenylacetone, 96%

CAS: 6305-95-9 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00045175 InChI Key: LWGNDIMNCPMZOF-UHFFFAOYSA-N Synonym: 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one PubChem CID: 229355 IUPAC Name: 1-(2-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1Cl

PubChem CID 229355
CAS 6305-95-9
Molecular Weight (g/mol) 168.62
MDL Number MFCD00045175
SMILES CC(=O)CC1=CC=CC=C1Cl
Synonym 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one
IUPAC Name 1-(2-chlorophenyl)propan-2-one
InChI Key LWGNDIMNCPMZOF-UHFFFAOYSA-N
Molecular Formula C9H9ClO
3,225

3-Fluoro-2-methylaniline, 98+%

CAS: 443-86-7 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007760 InChI Key: SLDLVGFPFFLYBM-UHFFFAOYSA-N Synonym: 3-fluoro-o-toluidine,2-fluoro-6-aminotoluene,2-amino-6-fluorotoluene,6-amino-2-fluorotoluene,3-fluoro-2-methyl-aniline,benzenamine, 3-fluoro-2-methyl,3-fluoro-2-methylphenylamine,2-methyl-3-fluoroaniline,hydrochloride,3-fluor-2-methylanilin PubChem CID: 285553 IUPAC Name: 3-fluoro-2-methylaniline SMILES: CC1=C(N)C=CC=C1F

PubChem CID 285553
CAS 443-86-7
Molecular Weight (g/mol) 125.15
MDL Number MFCD00007760
SMILES CC1=C(N)C=CC=C1F
Synonym 3-fluoro-o-toluidine,2-fluoro-6-aminotoluene,2-amino-6-fluorotoluene,6-amino-2-fluorotoluene,3-fluoro-2-methyl-aniline,benzenamine, 3-fluoro-2-methyl,3-fluoro-2-methylphenylamine,2-methyl-3-fluoroaniline,hydrochloride,3-fluor-2-methylanilin
IUPAC Name 3-fluoro-2-methylaniline
InChI Key SLDLVGFPFFLYBM-UHFFFAOYSA-N
Molecular Formula C7H8FN