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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 (64,917)
Phenols (11,904)
Naphthalenes (4,958)
Fluorenes (1,242)
Unsubstituted Phenols (1,173)
Thiophenols (609)
Phenol esters (426)
Anthracenes (400)
Tetralins (329)
Phenanthrenes and derivatives (300)
Triphenyl compounds (290)
Indanes (288)
Pyrenes (217)
Dibenzocycloheptenes (65)
Ellagic acids and derivatives (33)
Naphthacenes (31)
Acenaphthylenes (16)
Pentacenequinones (16)
Pentacenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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9,286 – 9,300 of 73,799 results
9,286

(3R)-(+)-1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine 98.0+%, TCI America™
SDP

CAS: 131878-23-4 Molecular Formula: C16H24N2O2 Molecular Weight (g/mol): 276.38 MDL Number: MFCD01321148 InChI Key: PHOIDJGLYWEUEK-CQSZACIVSA-N PubChem CID: 10286119 IUPAC Name: tert-butyl N-[(3R)-1-benzylpyrrolidin-3-yl]carbamate SMILES: CC(C)(C)OC(=O)NC1CCN(C1)CC2=CC=CC=C2

PubChem CID 10286119
CAS 131878-23-4
Molecular Weight (g/mol) 276.38
MDL Number MFCD01321148
SMILES CC(C)(C)OC(=O)NC1CCN(C1)CC2=CC=CC=C2
IUPAC Name tert-butyl N-[(3R)-1-benzylpyrrolidin-3-yl]carbamate
InChI Key PHOIDJGLYWEUEK-CQSZACIVSA-N
Molecular Formula C16H24N2O2
9,287

Monobenzyl Phthalate 98.0+%, TCI America™
SDP

CAS: 2528-16-7 Molecular Formula: C15H11CaO4 Molecular Weight (g/mol): 295.33 MDL Number: MFCD00020279 InChI Key: HLBMYHRBXPVVCC-UHFFFAOYSA-M Synonym: Benzyl Hydrogen Phthalate, Phthalic Acid Monobenzyl Ester PubChem CID: 31736 IUPAC Name: calcium 2-[(benzyloxy)carbonyl]benzoate SMILES: [Ca++].[O-]C(=O)C1=CC=CC=C1C(=O)OCC1=CC=CC=C1

PubChem CID 31736
CAS 2528-16-7
Molecular Weight (g/mol) 295.33
MDL Number MFCD00020279
SMILES [Ca++].[O-]C(=O)C1=CC=CC=C1C(=O)OCC1=CC=CC=C1
Synonym Benzyl Hydrogen Phthalate, Phthalic Acid Monobenzyl Ester
IUPAC Name calcium 2-[(benzyloxy)carbonyl]benzoate
InChI Key HLBMYHRBXPVVCC-UHFFFAOYSA-M
Molecular Formula C15H11CaO4
9,288

2-Fluoro-3-methylaniline 98.0+%, TCI America™
SDP

CAS: 1978-33-2 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD06410915 InChI Key: WFZUBZAEFXETBF-UHFFFAOYSA-N Synonym: 3-amino-2-fluorotoluene,2-fluoro-m-toluidine,2-fluoro-3-methylbenzenamine,3-amino-2-fluoro-toluene,2-fluoro-3-methyl-aniline,2-fluoro-3-methylphenylamine,2-fluoro-3-aminotoluene,benzenamine, 2-fluoro-3-methyl,2-fluoro-3-methyl-phenylamine,pubchem1536 PubChem CID: 22734623 IUPAC Name: 2-fluoro-3-methylaniline SMILES: CC1=C(F)C(N)=CC=C1

PubChem CID 22734623
CAS 1978-33-2
Molecular Weight (g/mol) 125.15
MDL Number MFCD06410915
SMILES CC1=C(F)C(N)=CC=C1
Synonym 3-amino-2-fluorotoluene,2-fluoro-m-toluidine,2-fluoro-3-methylbenzenamine,3-amino-2-fluoro-toluene,2-fluoro-3-methyl-aniline,2-fluoro-3-methylphenylamine,2-fluoro-3-aminotoluene,benzenamine, 2-fluoro-3-methyl,2-fluoro-3-methyl-phenylamine,pubchem1536
IUPAC Name 2-fluoro-3-methylaniline
InChI Key WFZUBZAEFXETBF-UHFFFAOYSA-N
Molecular Formula C7H8FN
9,289

3-Methyl-N-methylbenzylamine 97.0+%, TCI America™
SDP

CAS: 39180-84-2 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD05865181 InChI Key: WCTNVGNEUDTSOZ-UHFFFAOYSA-N Synonym: 3-methyl-n-methylbenzylamine,n-methyl-1-m-tolyl methanamine,3-methylbenzyl methylamine,methyl 3-methylphenyl methyl amine,benzenemethanamine, n,3-dimethyl,acmc-20a7fx,n,3-dimethylbenzylamine,methyl 3-methylbenzyl amine,n-methyl-3-methylbenzylamine,ksc493m5b PubChem CID: 13794465 IUPAC Name: N-methyl-1-(3-methylphenyl)methanamine SMILES: CC1=CC(=CC=C1)CNC

PubChem CID 13794465
CAS 39180-84-2
Molecular Weight (g/mol) 135.21
MDL Number MFCD05865181
SMILES CC1=CC(=CC=C1)CNC
Synonym 3-methyl-n-methylbenzylamine,n-methyl-1-m-tolyl methanamine,3-methylbenzyl methylamine,methyl 3-methylphenyl methyl amine,benzenemethanamine, n,3-dimethyl,acmc-20a7fx,n,3-dimethylbenzylamine,methyl 3-methylbenzyl amine,n-methyl-3-methylbenzylamine,ksc493m5b
IUPAC Name N-methyl-1-(3-methylphenyl)methanamine
InChI Key WCTNVGNEUDTSOZ-UHFFFAOYSA-N
Molecular Formula C9H13N
9,290

2-(Trifluoromethyl)-1,4-phenylenediamine 98.0+%, TCI America™
SDP

CAS: 364-13-6 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00036101 InChI Key: ZQQOGBKIFPCFMJ-UHFFFAOYSA-N Synonym: 2,5-Diaminobenzotrifluoride PubChem CID: 136197 IUPAC Name: 2-(trifluoromethyl)benzene-1,4-diamine SMILES: C1=CC(=C(C=C1N)C(F)(F)F)N

PubChem CID 136197
CAS 364-13-6
Molecular Weight (g/mol) 176.142
MDL Number MFCD00036101
SMILES C1=CC(=C(C=C1N)C(F)(F)F)N
Synonym 2,5-Diaminobenzotrifluoride
IUPAC Name 2-(trifluoromethyl)benzene-1,4-diamine
InChI Key ZQQOGBKIFPCFMJ-UHFFFAOYSA-N
Molecular Formula C7H7F3N2
9,291

4-Fluoro-4'-hydroxybiphenyl 98.0+%, TCI America™
SDP

CAS: 324-94-7 Molecular Formula: C12H9FO Molecular Weight (g/mol): 188.201 MDL Number: MFCD01830385 InChI Key: QSJNKJGPJVOGPK-UHFFFAOYSA-N Synonym: 4'-fluoro-1,1'-biphenyl-4-ol,4-fluoro-4'-hydroxybiphenyl,4-hydroxy-4'-fluorobiphenyl,4-4-fluorophenyl phenol,4'-fluoro-biphenyl-4-ol,4'-fluoro 1,1'-biphenyl-4-ol,4-4'-fluorophenyl phenol,4'-fluorobiphenyl-1-ol,1,1'-biphenyl-4-ol, 4'-fluoro,pubchem9057 PubChem CID: 345420 IUPAC Name: 4-(4-fluorophenyl)phenol SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)F)O

PubChem CID 345420
CAS 324-94-7
Molecular Weight (g/mol) 188.201
MDL Number MFCD01830385
SMILES C1=CC(=CC=C1C2=CC=C(C=C2)F)O
Synonym 4'-fluoro-1,1'-biphenyl-4-ol,4-fluoro-4'-hydroxybiphenyl,4-hydroxy-4'-fluorobiphenyl,4-4-fluorophenyl phenol,4'-fluoro-biphenyl-4-ol,4'-fluoro 1,1'-biphenyl-4-ol,4-4'-fluorophenyl phenol,4'-fluorobiphenyl-1-ol,1,1'-biphenyl-4-ol, 4'-fluoro,pubchem9057
IUPAC Name 4-(4-fluorophenyl)phenol
InChI Key QSJNKJGPJVOGPK-UHFFFAOYSA-N
Molecular Formula C12H9FO
9,292

4-Amino-3-methylbenzoic Acid 98.0+%, TCI America™
SDP

CAS: 2486-70-6 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 InChI Key: NHFKECPTBZZFBC-UHFFFAOYSA-N Synonym: 3-methyl-4-aminobenzoic acid,4-amino-m-toluic acid,benzoic acid, 4-amino-3-methyl,4-amino-3-methyl benzoic acid,4-amino-3-methyl benzoate,4-amino-3-methylbenzoicacid,unii-201cxt4h5v,4-amino-3-methyl-benzoic acid,benzoic acid, 3-methyl-4-amino,4-amino-3-methylbenzenecarboxylic acid PubChem CID: 75598 IUPAC Name: 4-amino-3-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)C(=O)O)N

PubChem CID 75598
CAS 2486-70-6
Molecular Weight (g/mol) 151.165
SMILES CC1=C(C=CC(=C1)C(=O)O)N
Synonym 3-methyl-4-aminobenzoic acid,4-amino-m-toluic acid,benzoic acid, 4-amino-3-methyl,4-amino-3-methyl benzoic acid,4-amino-3-methyl benzoate,4-amino-3-methylbenzoicacid,unii-201cxt4h5v,4-amino-3-methyl-benzoic acid,benzoic acid, 3-methyl-4-amino,4-amino-3-methylbenzenecarboxylic acid
IUPAC Name 4-amino-3-methylbenzoic acid
InChI Key NHFKECPTBZZFBC-UHFFFAOYSA-N
Molecular Formula C8H9NO2
9,293

N-Methyl-N-propargylbenzylamine 98.0+%, TCI America™
SDP

9,294

Methyl 4-Iodosalicylate 98.0+%, TCI America™
SDP

CAS: 18179-39-0 Molecular Formula: C8H7IO3 Molecular Weight (g/mol): 278.045 MDL Number: MFCD06797864 InChI Key: WUFUURSWOJROKY-UHFFFAOYSA-N Synonym: methyl 4-iodosalicylate,2-hydroxy-4-iodobenzoic acid methyl ester,benzoic acid,2-hydroxy-4-iodo-, methyl ester,methyl-4-iodosalicylate,methyl 4-iodosalicyclate,acmc-1c81e,methyl2-hydroxy-4-iodobenzoate,methyl 4-iodo-2-hydroxybenzoate,methyl-2-hydroxy-4-iodo-benzoate PubChem CID: 11380407 IUPAC Name: methyl 2-hydroxy-4-iodobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)I)O

PubChem CID 11380407
CAS 18179-39-0
Molecular Weight (g/mol) 278.045
MDL Number MFCD06797864
SMILES COC(=O)C1=C(C=C(C=C1)I)O
Synonym methyl 4-iodosalicylate,2-hydroxy-4-iodobenzoic acid methyl ester,benzoic acid,2-hydroxy-4-iodo-, methyl ester,methyl-4-iodosalicylate,methyl 4-iodosalicyclate,acmc-1c81e,methyl2-hydroxy-4-iodobenzoate,methyl 4-iodo-2-hydroxybenzoate,methyl-2-hydroxy-4-iodo-benzoate
IUPAC Name methyl 2-hydroxy-4-iodobenzoate
InChI Key WUFUURSWOJROKY-UHFFFAOYSA-N
Molecular Formula C8H7IO3
9,295

4-Amino-2,5-xylenol 97.0+%, TCI America™
SDP

CAS: 3096-71-7 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 InChI Key: JSWVCUXQICMATE-UHFFFAOYSA-N Synonym: 4-amino-2,5-xylenol,phenol, 4-amino-2,5-dimethyl,unii-rf4r93709t,2,5-dimethyl-4-aminophenol,4-amino-2,5-dimethyl-phenol,4-hydroxy-2,5-dimethylaniline,acmc-209hjo,2,5-dimethy-4-aminophenol,2,5-xylenol, 4-amino,ksc495q0r PubChem CID: 76544 IUPAC Name: 4-amino-2,5-dimethylphenol SMILES: CC1=CC(=C(C=C1O)C)N

PubChem CID 76544
CAS 3096-71-7
Molecular Weight (g/mol) 137.182
SMILES CC1=CC(=C(C=C1O)C)N
Synonym 4-amino-2,5-xylenol,phenol, 4-amino-2,5-dimethyl,unii-rf4r93709t,2,5-dimethyl-4-aminophenol,4-amino-2,5-dimethyl-phenol,4-hydroxy-2,5-dimethylaniline,acmc-209hjo,2,5-dimethy-4-aminophenol,2,5-xylenol, 4-amino,ksc495q0r
IUPAC Name 4-amino-2,5-dimethylphenol
InChI Key JSWVCUXQICMATE-UHFFFAOYSA-N
Molecular Formula C8H11NO
9,296

2-Methoxy-4-nitrobenzenesulfonyl Chloride 98.0+%, TCI America™
SDP

CAS: 21320-91-2 Molecular Formula: C7H6ClNO5S Molecular Weight (g/mol): 251.64 MDL Number: MFCD03094697 InChI Key: QECYXMKYZQXEHM-UHFFFAOYSA-N Synonym: 2-methoxy-4-nitrobenzene-1-sulfonyl chloride,2-methoxy-4-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methoxy-4-nitro,pubchem11714,acmc-1ck5c,ksc207c7t,2-chlorosulphonyl-5-nitroanisole,chloro 2-methoxy-4-nitrophenyl sulfone,2-methoxy-4-nitrobenzensulfonyl chloride,2-methoxy-4-nitrophenylsulfonyl chloride PubChem CID: 309458 IUPAC Name: 2-methoxy-4-nitrobenzene-1-sulfonyl chloride SMILES: COC1=CC(=CC=C1S(Cl)(=O)=O)[N+]([O-])=O

PubChem CID 309458
CAS 21320-91-2
Molecular Weight (g/mol) 251.64
MDL Number MFCD03094697
SMILES COC1=CC(=CC=C1S(Cl)(=O)=O)[N+]([O-])=O
Synonym 2-methoxy-4-nitrobenzene-1-sulfonyl chloride,2-methoxy-4-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methoxy-4-nitro,pubchem11714,acmc-1ck5c,ksc207c7t,2-chlorosulphonyl-5-nitroanisole,chloro 2-methoxy-4-nitrophenyl sulfone,2-methoxy-4-nitrobenzensulfonyl chloride,2-methoxy-4-nitrophenylsulfonyl chloride
IUPAC Name 2-methoxy-4-nitrobenzene-1-sulfonyl chloride
InChI Key QECYXMKYZQXEHM-UHFFFAOYSA-N
Molecular Formula C7H6ClNO5S
9,297

4-(Methylthio)aniline 98.0+%, TCI America™
SDP

CAS: 104-96-1 Molecular Formula: C7H9NS Molecular Weight (g/mol): 139.22 MDL Number: MFCD00007889 InChI Key: YKFROQCFVXOUPW-UHFFFAOYSA-N Synonym: 4-methylthio aniline,4-methylmercapto aniline,4-aminothioanisole,p-thioanisidine,benzenamine, 4-methylthio,p-methylthio aniline,p-aminothioanisole,p-thiomethoxyaniline,4-methylsulfanyl aniline,4-methylthio benzenamine PubChem CID: 66038 IUPAC Name: 4-(methylsulfanyl)aniline SMILES: CSC1=CC=C(N)C=C1

PubChem CID 66038
CAS 104-96-1
Molecular Weight (g/mol) 139.22
MDL Number MFCD00007889
SMILES CSC1=CC=C(N)C=C1
Synonym 4-methylthio aniline,4-methylmercapto aniline,4-aminothioanisole,p-thioanisidine,benzenamine, 4-methylthio,p-methylthio aniline,p-aminothioanisole,p-thiomethoxyaniline,4-methylsulfanyl aniline,4-methylthio benzenamine
IUPAC Name 4-(methylsulfanyl)aniline
InChI Key YKFROQCFVXOUPW-UHFFFAOYSA-N
Molecular Formula C7H9NS
9,298

2,5-Difluorobenzyl Chloride 98.0+%, TCI America™
SDP

CAS: 495-07-8 Molecular Formula: C7H5ClF2 Molecular Weight (g/mol): 162.564 MDL Number: MFCD01090989 InChI Key: INXKTZMJFPRVAY-UHFFFAOYSA-N Synonym: 2,5-difluorobenzyl chloride,2-chloromethyl-1,4-difluorobenzene,2,5-difluorobenzylchloride,alpha-chloro-2,5-difluorotoluene,benzene, 2-chloromethyl-1,4-difluoro,2-chloromethyl-1,4-bis fluoranyl benzene,2-chloromethyl-1,4-difluoro-benzene,acmc-1an3f,ksc591g4f PubChem CID: 2736950 IUPAC Name: 2-(chloromethyl)-1,4-difluorobenzene SMILES: C1=CC(=C(C=C1F)CCl)F

PubChem CID 2736950
CAS 495-07-8
Molecular Weight (g/mol) 162.564
MDL Number MFCD01090989
SMILES C1=CC(=C(C=C1F)CCl)F
Synonym 2,5-difluorobenzyl chloride,2-chloromethyl-1,4-difluorobenzene,2,5-difluorobenzylchloride,alpha-chloro-2,5-difluorotoluene,benzene, 2-chloromethyl-1,4-difluoro,2-chloromethyl-1,4-bis fluoranyl benzene,2-chloromethyl-1,4-difluoro-benzene,acmc-1an3f,ksc591g4f
IUPAC Name 2-(chloromethyl)-1,4-difluorobenzene
InChI Key INXKTZMJFPRVAY-UHFFFAOYSA-N
Molecular Formula C7H5ClF2
9,299

4-Pentyloxyphthalonitrile 98.0+%, TCI America™
SDP

CAS: 106943-83-3 Molecular Formula: C13H14N2O Molecular Weight (g/mol): 214.268 MDL Number: MFCD00059103 InChI Key: LEYRHJFOAFEIDH-UHFFFAOYSA-N Synonym: 4-Amyloxyphthalonitrile, 1,2-Dicyano-4-pentyloxybenzene PubChem CID: 537786 IUPAC Name: 4-pentoxybenzene-1,2-dicarbonitrile SMILES: CCCCCOC1=CC(=C(C=C1)C#N)C#N

PubChem CID 537786
CAS 106943-83-3
Molecular Weight (g/mol) 214.268
MDL Number MFCD00059103
SMILES CCCCCOC1=CC(=C(C=C1)C#N)C#N
Synonym 4-Amyloxyphthalonitrile, 1,2-Dicyano-4-pentyloxybenzene
IUPAC Name 4-pentoxybenzene-1,2-dicarbonitrile
InChI Key LEYRHJFOAFEIDH-UHFFFAOYSA-N
Molecular Formula C13H14N2O
9,300

4-Chloro-3-nitrobenzamide 98.0+%, TCI America™
SDP

CAS: 16588-06-0 Molecular Formula: C7H5ClN2O3 Molecular Weight (g/mol): 200.578 MDL Number: MFCD00017134 InChI Key: CGXRJCDXGJRBHV-UHFFFAOYSA-N PubChem CID: 27942 IUPAC Name: 4-chloro-3-nitrobenzamide SMILES: C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])Cl

PubChem CID 27942
CAS 16588-06-0
Molecular Weight (g/mol) 200.578
MDL Number MFCD00017134
SMILES C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])Cl
IUPAC Name 4-chloro-3-nitrobenzamide
InChI Key CGXRJCDXGJRBHV-UHFFFAOYSA-N
Molecular Formula C7H5ClN2O3