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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 (58,795)
Phenols (9,101)
Naphthalenes (4,481)
Fluorenes (1,015)
Unsubstituted Phenols (992)
Thiophenols (620)
Phenol esters (487)
Anthracenes (392)
Tetralins (309)
Triphenyl compounds (288)
Phenanthrenes and derivatives (266)
Indanes (252)
Pyrenes (195)
Dibenzocycloheptenes (62)
Naphthacenes (31)
Ellagic acids and derivatives (24)
Pentacenequinones (16)
Pentacenes (15)
Acenaphthylenes (12)
1-hydroxylamino 2-unsubstituted benzenoids (6)
Perylenequinones (3)

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4,576 – 4,590 of 64,285 results
4,576

Thermo Scientific Chemicals Benzaldehyde dimethyl acetal, 99%

CAS: 1125-88-8 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00008491 InChI Key: HEVMDQBCAHEHDY-UHFFFAOYSA-N Synonym: benzaldehyde dimethyl acetal,dimethoxymethyl benzene,alpha,alpha-dimethoxytoluene,dimethoxyphenylmethane,benzene, dimethoxymethyl,benzaldehydedimethylacetal,dimethoxymethyl-benzene,benzaldehyde, dimethyl acetal,benzaldehyde dimethylacetal,unii-w6t83k35ca PubChem CID: 62375 IUPAC Name: dimethoxymethylbenzene SMILES: COC(C1=CC=CC=C1)OC

PubChem CID 62375
CAS 1125-88-8
Molecular Weight (g/mol) 152.193
MDL Number MFCD00008491
SMILES COC(C1=CC=CC=C1)OC
Synonym benzaldehyde dimethyl acetal,dimethoxymethyl benzene,alpha,alpha-dimethoxytoluene,dimethoxyphenylmethane,benzene, dimethoxymethyl,benzaldehydedimethylacetal,dimethoxymethyl-benzene,benzaldehyde, dimethyl acetal,benzaldehyde dimethylacetal,unii-w6t83k35ca
IUPAC Name dimethoxymethylbenzene
InChI Key HEVMDQBCAHEHDY-UHFFFAOYSA-N
Molecular Formula C9H12O2
4,577

Thermo Scientific Chemicals 4-Chlorothioanisole, 98%

CAS: 123-09-1 Molecular Formula: C7H7ClS Molecular Weight (g/mol): 158.643 MDL Number: MFCD00013643 InChI Key: KIQQUVJOLVCZKG-UHFFFAOYSA-N Synonym: 4-chlorothioanisole,4-chlorophenyl methyl sulfide,p-chlorothioanisole,1-chloro-4-methylthio benzene,p-chlorophenyl methyl sulfide,methyl 4-chlorophenyl sulfide,benzene, 1-chloro-4-methylthio,p-chlophenyl methyl sulfide,1-chloro-4-methylsulfanyl benzene,4-chloro thioanisole PubChem CID: 31243 IUPAC Name: 1-chloro-4-methylsulfanylbenzene SMILES: CSC1=CC=C(C=C1)Cl

PubChem CID 31243
CAS 123-09-1
Molecular Weight (g/mol) 158.643
MDL Number MFCD00013643
SMILES CSC1=CC=C(C=C1)Cl
Synonym 4-chlorothioanisole,4-chlorophenyl methyl sulfide,p-chlorothioanisole,1-chloro-4-methylthio benzene,p-chlorophenyl methyl sulfide,methyl 4-chlorophenyl sulfide,benzene, 1-chloro-4-methylthio,p-chlophenyl methyl sulfide,1-chloro-4-methylsulfanyl benzene,4-chloro thioanisole
IUPAC Name 1-chloro-4-methylsulfanylbenzene
InChI Key KIQQUVJOLVCZKG-UHFFFAOYSA-N
Molecular Formula C7H7ClS
4,578

Thermo Scientific Chemicals 4-Vinylbenzoic acid, 98%

CAS: 1075-49-6 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00002569 InChI Key: IRQWEODKXLDORP-UHFFFAOYSA-N Synonym: 4-vinylbenzoic acid,p-vinylbenzoic acid,4-carboxystyrene,benzoic acid, 4-ethenyl,styrene-4-carboxylic acid,4-vinyl-benzoic acid,p-vinyl benzoic acid,4-vinyl benzoic acid,para-vinyl benzoic acid,pubchem12624 PubChem CID: 14098 IUPAC Name: 4-ethenylbenzoic acid SMILES: C=CC1=CC=C(C=C1)C(=O)O

PubChem CID 14098
CAS 1075-49-6
Molecular Weight (g/mol) 148.161
MDL Number MFCD00002569
SMILES C=CC1=CC=C(C=C1)C(=O)O
Synonym 4-vinylbenzoic acid,p-vinylbenzoic acid,4-carboxystyrene,benzoic acid, 4-ethenyl,styrene-4-carboxylic acid,4-vinyl-benzoic acid,p-vinyl benzoic acid,4-vinyl benzoic acid,para-vinyl benzoic acid,pubchem12624
IUPAC Name 4-ethenylbenzoic acid
InChI Key IRQWEODKXLDORP-UHFFFAOYSA-N
Molecular Formula C9H8O2
4,579

Thermo Scientific Chemicals 2-Bromo-5-fluorotoluene, 98+%

CAS: 452-63-1 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00017921 InChI Key: RJPNVPITBYXBNB-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorotoluene,3-fluoro-6-bromotoluene,2-bromo-5-fluoro toluene,benzene, 1-bromo-4-fluoro-2-methyl,5-fluoro-2-bromotoluene,1-bromo-4-fluoro-2-methyl-benzene,pubchem1603,2-bromo-5fluorotoluene,acmc-1acnn,2-bromo-5-fluoro-toluene PubChem CID: 96743 IUPAC Name: 1-bromo-4-fluoro-2-methylbenzene SMILES: CC1=C(C=CC(=C1)F)Br

PubChem CID 96743
CAS 452-63-1
Molecular Weight (g/mol) 189.027
MDL Number MFCD00017921
SMILES CC1=C(C=CC(=C1)F)Br
Synonym 2-bromo-5-fluorotoluene,3-fluoro-6-bromotoluene,2-bromo-5-fluoro toluene,benzene, 1-bromo-4-fluoro-2-methyl,5-fluoro-2-bromotoluene,1-bromo-4-fluoro-2-methyl-benzene,pubchem1603,2-bromo-5fluorotoluene,acmc-1acnn,2-bromo-5-fluoro-toluene
IUPAC Name 1-bromo-4-fluoro-2-methylbenzene
InChI Key RJPNVPITBYXBNB-UHFFFAOYSA-N
Molecular Formula C7H6BrF
4,580

Thermo Scientific Chemicals 3-Benzoylacrylic acid, predominantly trans, 97%

CAS: 583-06-2 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.171 MDL Number: MFCD00014015 InChI Key: PLPDHGOODMBBGN-VOTSOKGWSA-N Synonym: 3-benzoylacrylic acid,benzoylacrylic acid,4-oxo-4-phenyl-2-butenoic acid,e-4-oxo-4-phenylbut-2-enoic acid,acrylic acid, 3-benzoyl,2-butenoic acid, 4-oxo-4-phenyl,4-oxo-4-phenylbut-2-enoic acid,crotonic acid, 4-oxo-4-phenyl,.beta.-benzoylacrylic acid,trans-3-benzoylacrylic acid PubChem CID: 676116 IUPAC Name: (E)-4-oxo-4-phenylbut-2-enoic acid SMILES: C1=CC=C(C=C1)C(=O)C=CC(=O)O

PubChem CID 676116
CAS 583-06-2
Molecular Weight (g/mol) 176.171
MDL Number MFCD00014015
SMILES C1=CC=C(C=C1)C(=O)C=CC(=O)O
Synonym 3-benzoylacrylic acid,benzoylacrylic acid,4-oxo-4-phenyl-2-butenoic acid,e-4-oxo-4-phenylbut-2-enoic acid,acrylic acid, 3-benzoyl,2-butenoic acid, 4-oxo-4-phenyl,4-oxo-4-phenylbut-2-enoic acid,crotonic acid, 4-oxo-4-phenyl,.beta.-benzoylacrylic acid,trans-3-benzoylacrylic acid
IUPAC Name (E)-4-oxo-4-phenylbut-2-enoic acid
InChI Key PLPDHGOODMBBGN-VOTSOKGWSA-N
Molecular Formula C10H8O3
4,581

Thermo Scientific Chemicals 4-Fluorobenzophenone, 97%

CAS: 345-83-5 Molecular Formula: C13H9FO Molecular Weight (g/mol): 200.21 MDL Number: MFCD00000352 InChI Key: OGTSHGYHILFRHD-UHFFFAOYSA-N Synonym: 4-fluorobenzophenone,4-fluorophenyl phenyl methanone,p-fluorobenzophenone,methanone, 4-fluorophenyl phenyl,4-fluorophenyl phenyl ketone,4-fluorophenyl-phenylmethanone,4'-fluorobenzophenone,4-fluoro-benzophenone,pubchem3308,benzophenone, 4-fluoro PubChem CID: 67663 IUPAC Name: (4-fluorophenyl)-phenylmethanone SMILES: FC1=CC=C(C=C1)C(=O)C1=CC=CC=C1

PubChem CID 67663
CAS 345-83-5
Molecular Weight (g/mol) 200.21
MDL Number MFCD00000352
SMILES FC1=CC=C(C=C1)C(=O)C1=CC=CC=C1
Synonym 4-fluorobenzophenone,4-fluorophenyl phenyl methanone,p-fluorobenzophenone,methanone, 4-fluorophenyl phenyl,4-fluorophenyl phenyl ketone,4-fluorophenyl-phenylmethanone,4'-fluorobenzophenone,4-fluoro-benzophenone,pubchem3308,benzophenone, 4-fluoro
IUPAC Name (4-fluorophenyl)-phenylmethanone
InChI Key OGTSHGYHILFRHD-UHFFFAOYSA-N
Molecular Formula C13H9FO
4,582

Thermo Scientific Chemicals 3,3',5,5'-Tetrakis(trifluoromethyl)benzophenone, 98%

CAS: 175136-66-0 Molecular Formula: C17H6F12O Molecular Weight (g/mol): 454.215 MDL Number: MFCD00042474 InChI Key: GATWMPGNBWPCIY-UHFFFAOYSA-N Synonym: 3,3',5,5'-tetrakis trifluoromethyl benzophenone,bis 3,5-bis trifluoromethyl phenyl methanone,maybridge1_002937,acmc-1c7yy,bis 3,5-bis trifluoromethyl phenyl ketone,di 3,5-di trifluoromethyl phenyl methanone,bis 3,5-bis trifluoromethyl phenyl methanone #,3,3/',5,5/'-tetrakis trifluoromethyl benzophenone PubChem CID: 519439 IUPAC Name: bis[3,5-bis(trifluoromethyl)phenyl]methanone SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

PubChem CID 519439
CAS 175136-66-0
Molecular Weight (g/mol) 454.215
MDL Number MFCD00042474
SMILES C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
Synonym 3,3',5,5'-tetrakis trifluoromethyl benzophenone,bis 3,5-bis trifluoromethyl phenyl methanone,maybridge1_002937,acmc-1c7yy,bis 3,5-bis trifluoromethyl phenyl ketone,di 3,5-di trifluoromethyl phenyl methanone,bis 3,5-bis trifluoromethyl phenyl methanone #,3,3/',5,5/'-tetrakis trifluoromethyl benzophenone
IUPAC Name bis[3,5-bis(trifluoromethyl)phenyl]methanone
InChI Key GATWMPGNBWPCIY-UHFFFAOYSA-N
Molecular Formula C17H6F12O
4,583

4'-Ethoxyacetanilide, 97%, Thermo Scientific Chemicals

CAS: 62-44-2 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.219 MDL Number: MFCD00009094 InChI Key: CPJSUEIXXCENMM-UHFFFAOYSA-N Synonym: phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin PubChem CID: 4754 ChEBI: CHEBI:8050 IUPAC Name: N-(4-ethoxyphenyl)acetamide SMILES: CCOC1=CC=C(C=C1)NC(=O)C

PubChem CID 4754
CAS 62-44-2
Molecular Weight (g/mol) 179.219
ChEBI CHEBI:8050
MDL Number MFCD00009094
SMILES CCOC1=CC=C(C=C1)NC(=O)C
Synonym phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin
IUPAC Name N-(4-ethoxyphenyl)acetamide
InChI Key CPJSUEIXXCENMM-UHFFFAOYSA-N
Molecular Formula C10H13NO2
4,584

Thermo Scientific Chemicals 4-Acetamidophenol, 98%

CAS: 103-90-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00002328 InChI Key: RZVAJINKPMORJF-UHFFFAOYSA-N Synonym: acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol PubChem CID: 1983 ChEBI: CHEBI:46195 IUPAC Name: N-(4-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=C(O)C=C1

PubChem CID 1983
CAS 103-90-2
Molecular Weight (g/mol) 151.17
ChEBI CHEBI:46195
MDL Number MFCD00002328
SMILES CC(=O)NC1=CC=C(O)C=C1
Synonym acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol
IUPAC Name N-(4-hydroxyphenyl)acetamide
InChI Key RZVAJINKPMORJF-UHFFFAOYSA-N
Molecular Formula C8H9NO2
4,585

Thermo Scientific Chemicals Phenylhydrazine, 97%

CAS: 100-63-0 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.14 MDL Number: MFCD00007573 InChI Key: HKOOXMFOFWEVGF-UHFFFAOYSA-N Synonym: hydrazinobenzene,hydrazine, phenyl,phenylhydrazin,monophenylhydrazine,phenyl hydrazine,1-phenylhydrazine,hydrazine-benzene,fenilidrazina,fenylhydrazine,fenylhydrazine dutch PubChem CID: 7516 ChEBI: CHEBI:27924 IUPAC Name: phenylhydrazine SMILES: NNC1=CC=CC=C1

PubChem CID 7516
CAS 100-63-0
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:27924
MDL Number MFCD00007573
SMILES NNC1=CC=CC=C1
Synonym hydrazinobenzene,hydrazine, phenyl,phenylhydrazin,monophenylhydrazine,phenyl hydrazine,1-phenylhydrazine,hydrazine-benzene,fenilidrazina,fenylhydrazine,fenylhydrazine dutch
IUPAC Name phenylhydrazine
InChI Key HKOOXMFOFWEVGF-UHFFFAOYSA-N
Molecular Formula C6H8N2
4,586

Thermo Scientific Chemicals 9-Anthraldehyde, 98%

CAS: 642-31-9 Molecular Formula: C15H10O Molecular Weight (g/mol): 206.24 MDL Number: MFCD00001254 InChI Key: YMNKUHIVVMFOFO-UHFFFAOYSA-N Synonym: 9-anthraldehyde,9-anthracenecarboxaldehyde,9-anthrylaldehyde,9-formylanthracene,9-anthracenecarbaldehyde,9-anthrylcarboxaldehyde,ccris 3165,nsc 15,anthracene-9-aldehyde,anthracene-9-carboxaldehyde PubChem CID: 69504 IUPAC Name: anthracene-9-carbaldehyde SMILES: O=CC1=C2C=CC=CC2=CC2=CC=CC=C12

PubChem CID 69504
CAS 642-31-9
Molecular Weight (g/mol) 206.24
MDL Number MFCD00001254
SMILES O=CC1=C2C=CC=CC2=CC2=CC=CC=C12
Synonym 9-anthraldehyde,9-anthracenecarboxaldehyde,9-anthrylaldehyde,9-formylanthracene,9-anthracenecarbaldehyde,9-anthrylcarboxaldehyde,ccris 3165,nsc 15,anthracene-9-aldehyde,anthracene-9-carboxaldehyde
IUPAC Name anthracene-9-carbaldehyde
InChI Key YMNKUHIVVMFOFO-UHFFFAOYSA-N
Molecular Formula C15H10O
4,587

Thermo Scientific Chemicals 2-Bromobenzyl bromide, 98%

CAS: 3433-80-5 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.933 MDL Number: MFCD00000173 InChI Key: LZSYGJNFCREHMD-UHFFFAOYSA-N Synonym: 2-bromobenzyl bromide,o-bromobenzyl bromide,1-bromo-2-bromomethyl benzene,2-bromobenzylbromide,alpha,2-dibromotoluene,benzene, 1-bromo-2-bromomethyl,alpha,o-dibromotoluene,benzene, bromo bromomethyl,alpha-2-dibromotoluene,a,o-dibromotoluene PubChem CID: 76965 IUPAC Name: 1-bromo-2-(bromomethyl)benzene SMILES: C1=CC=C(C(=C1)CBr)Br

PubChem CID 76965
CAS 3433-80-5
Molecular Weight (g/mol) 249.933
MDL Number MFCD00000173
SMILES C1=CC=C(C(=C1)CBr)Br
Synonym 2-bromobenzyl bromide,o-bromobenzyl bromide,1-bromo-2-bromomethyl benzene,2-bromobenzylbromide,alpha,2-dibromotoluene,benzene, 1-bromo-2-bromomethyl,alpha,o-dibromotoluene,benzene, bromo bromomethyl,alpha-2-dibromotoluene,a,o-dibromotoluene
IUPAC Name 1-bromo-2-(bromomethyl)benzene
InChI Key LZSYGJNFCREHMD-UHFFFAOYSA-N
Molecular Formula C7H6Br2
4,588

Thermo Scientific Chemicals 2,6-Difluorobenzoyl chloride, 98%

CAS: 18063-02-0 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.547 MDL Number: MFCD00000659 InChI Key: QRHUZEVERIHEPT-UHFFFAOYSA-N Synonym: 2,6-difluorobenzoylchloride,benzoyl chloride, 2,6-difluoro,2,6-difluoro-benzoyl chloride,acmc-1ca8w,2,6-diflurobenzoyl chloride,2 6-difluorobenzoyl chloride,2,6-diflourobenzoyl chloride,2,6-difluoro benzoylchloride,2.6-difluorobenzoyl chloride,2,6-difluro-benzoyl chloride PubChem CID: 87438 IUPAC Name: 2,6-difluorobenzoyl chloride SMILES: C1=CC(=C(C(=C1)F)C(=O)Cl)F

PubChem CID 87438
CAS 18063-02-0
Molecular Weight (g/mol) 176.547
MDL Number MFCD00000659
SMILES C1=CC(=C(C(=C1)F)C(=O)Cl)F
Synonym 2,6-difluorobenzoylchloride,benzoyl chloride, 2,6-difluoro,2,6-difluoro-benzoyl chloride,acmc-1ca8w,2,6-diflurobenzoyl chloride,2 6-difluorobenzoyl chloride,2,6-diflourobenzoyl chloride,2,6-difluoro benzoylchloride,2.6-difluorobenzoyl chloride,2,6-difluro-benzoyl chloride
IUPAC Name 2,6-difluorobenzoyl chloride
InChI Key QRHUZEVERIHEPT-UHFFFAOYSA-N
Molecular Formula C7H3ClF2O
4,589

Thermo Scientific Chemicals 3-Methyl-4-nitrobenzonitrile, 97%

CAS: 96784-54-2 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00017615 InChI Key: IHVNKSXTJZNBQA-UHFFFAOYSA-N Synonym: benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa PubChem CID: 2801434 IUPAC Name: 3-methyl-4-nitrobenzonitrile SMILES: CC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

PubChem CID 2801434
CAS 96784-54-2
Molecular Weight (g/mol) 162.148
MDL Number MFCD00017615
SMILES CC1=C(C=CC(=C1)C#N)[N+](=O)[O-]
Synonym benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa
IUPAC Name 3-methyl-4-nitrobenzonitrile
InChI Key IHVNKSXTJZNBQA-UHFFFAOYSA-N
Molecular Formula C8H6N2O2
4,590

Thermo Scientific Chemicals 4-Aminophenylacetonitrile, 99%

CAS: 3544-25-0 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00007912 InChI Key: YCWRFIYBUQBHJI-UHFFFAOYSA-N Synonym: 4-aminobenzyl cyanide,4-aminophenylacetonitrile,2-4-aminophenyl acetonitrile,4-aminophenyl acetonitrile,p-aminobenzyl cyanide,benzeneacetonitrile, 4-amino,4-aminobenzylcyanide,4-amino-phenyl-acetonitrile,2-4-aminophenyl ethanenitrile,4-aminobenzyl PubChem CID: 77000 IUPAC Name: 2-(4-aminophenyl)acetonitrile SMILES: NC1=CC=C(CC#N)C=C1

PubChem CID 77000
CAS 3544-25-0
Molecular Weight (g/mol) 132.17
MDL Number MFCD00007912
SMILES NC1=CC=C(CC#N)C=C1
Synonym 4-aminobenzyl cyanide,4-aminophenylacetonitrile,2-4-aminophenyl acetonitrile,4-aminophenyl acetonitrile,p-aminobenzyl cyanide,benzeneacetonitrile, 4-amino,4-aminobenzylcyanide,4-amino-phenyl-acetonitrile,2-4-aminophenyl ethanenitrile,4-aminobenzyl
IUPAC Name 2-(4-aminophenyl)acetonitrile
InChI Key YCWRFIYBUQBHJI-UHFFFAOYSA-N
Molecular Formula C8H8N2