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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 (67,624)
Phenols (13,427)
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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9,811 – 9,825 of 78,442 results
9,811

Methyl (Phenylthio)acetate, TCI America™

CAS: 17277-58-6 Molecular Formula: C9H10O2S Molecular Weight (g/mol): 182.237 MDL Number: MFCD00039805 InChI Key: MUNSXQQODXYRKI-UHFFFAOYSA-N Synonym: methyl phenylthio acetate,methyl 2-phenylthio acetate,methyl phenylsulfanyl acetate,phenylthio acetic acid methyl ester,methyl 2-phenylsulfanyl acetate,acetic acid, phenylthio-, methyl ester,methyl 2-phenylthioacetate,pubchem10851 PubChem CID: 123375 IUPAC Name: methyl 2-phenylsulfanylacetate SMILES: COC(=O)CSC1=CC=CC=C1

PubChem CID 123375
CAS 17277-58-6
Molecular Weight (g/mol) 182.237
MDL Number MFCD00039805
SMILES COC(=O)CSC1=CC=CC=C1
Synonym methyl phenylthio acetate,methyl 2-phenylthio acetate,methyl phenylsulfanyl acetate,phenylthio acetic acid methyl ester,methyl 2-phenylsulfanyl acetate,acetic acid, phenylthio-, methyl ester,methyl 2-phenylthioacetate,pubchem10851
IUPAC Name methyl 2-phenylsulfanylacetate
InChI Key MUNSXQQODXYRKI-UHFFFAOYSA-N
Molecular Formula C9H10O2S
9,812

9,9-Dimethyl-2-nitrofluorene 98.0+%, TCI America™

CAS: 605644-46-0 Molecular Formula: C15H13NO2 Molecular Weight (g/mol): 239.274 MDL Number: MFCD17170053 InChI Key: SPNVINZCDHRVAI-UHFFFAOYSA-N PubChem CID: 46912048 IUPAC Name: 9,9-dimethyl-2-nitrofluorene SMILES: CC1(C2=CC=CC=C2C3=C1C=C(C=C3)[N+](=O)[O-])C

PubChem CID 46912048
CAS 605644-46-0
Molecular Weight (g/mol) 239.274
MDL Number MFCD17170053
SMILES CC1(C2=CC=CC=C2C3=C1C=C(C=C3)[N+](=O)[O-])C
IUPAC Name 9,9-dimethyl-2-nitrofluorene
InChI Key SPNVINZCDHRVAI-UHFFFAOYSA-N
Molecular Formula C15H13NO2
9,813

Rivastigmine L-Tartrate 98.0+%, TCI America™

CAS: 129101-54-8 Molecular Formula: C18H28N2O8 Molecular Weight (g/mol): 400.43 MDL Number: MFCD03700731 InChI Key: GWHQHAUAXRMMOT-RWALOXMOSA-N Synonym: rivastigmine tartrate,rivastigmine bitartrate,sdz-ena 713,rivastigmine hydrogen tartrate,rivastigmine hydrogentartrate,unii-9iy2357jpe,s-3-1-dimethylamino ethyl phenyl ethyl methyl carbamate 2r,3r-2,3-dihydroxysuccinate,rivastigmine tartrate exelon,carbamic acid, ethylmethyl-, 3-1s-1-dimethylamino ethyl phenyl ester, 2r,3r-2,3-dihydroxybutanedioate 1:1 PubChem CID: 6918078 ChEBI: CHEBI:64358 IUPAC Name: (2S,3S)-2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate SMILES: O[C@@H]([C@H](O)C(O)=O)C(O)=O.CCN(C)C(=O)OC1=CC=CC(=C1)[C@H](C)N(C)C

PubChem CID 6918078
CAS 129101-54-8
Molecular Weight (g/mol) 400.43
ChEBI CHEBI:64358
MDL Number MFCD03700731
SMILES O[C@@H]([C@H](O)C(O)=O)C(O)=O.CCN(C)C(=O)OC1=CC=CC(=C1)[C@H](C)N(C)C
Synonym rivastigmine tartrate,rivastigmine bitartrate,sdz-ena 713,rivastigmine hydrogen tartrate,rivastigmine hydrogentartrate,unii-9iy2357jpe,s-3-1-dimethylamino ethyl phenyl ethyl methyl carbamate 2r,3r-2,3-dihydroxysuccinate,rivastigmine tartrate exelon,carbamic acid, ethylmethyl-, 3-1s-1-dimethylamino ethyl phenyl ester, 2r,3r-2,3-dihydroxybutanedioate 1:1
IUPAC Name (2S,3S)-2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate
InChI Key GWHQHAUAXRMMOT-RWALOXMOSA-N
Molecular Formula C18H28N2O8
9,814

Ethyl 4-Bromo-3-methylbenzoate 98.0+%, TCI America™

CAS: 160313-69-9 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.10 MDL Number: MFCD00673007 InChI Key: GIGDAWLJINYIFV-UHFFFAOYSA-N Synonym: 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester PubChem CID: 21729626 IUPAC Name: ethyl 4-bromo-3-methylbenzoate SMILES: CCOC(=O)C1=CC(C)=C(Br)C=C1

PubChem CID 21729626
CAS 160313-69-9
Molecular Weight (g/mol) 243.10
MDL Number MFCD00673007
SMILES CCOC(=O)C1=CC(C)=C(Br)C=C1
Synonym 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester
IUPAC Name ethyl 4-bromo-3-methylbenzoate
InChI Key GIGDAWLJINYIFV-UHFFFAOYSA-N
Molecular Formula C10H11BrO2
9,815

3-Bromo-4-(trifluoromethoxy)aniline 97.0+%, TCI America™

CAS: 191602-54-7 Molecular Formula: C7H5BrF3NO Molecular Weight (g/mol): 256.022 MDL Number: MFCD00190127 InChI Key: RAQMUBDHNKQNTD-UHFFFAOYSA-N Synonym: 3-bromo-4-trifluoromethoxy aniline,3-bromo-4-trifluoromethoxy benzenamine,4-amino-2-bromo trifluoromethoxy benzene,3-bromo-4-trifluoromethoxy-phenylamine,2-bromo-4-amino-trifluoromethoxybenzene,benzenamine, 3-bromo-4-trifluoromethoxy,1-amino-3-bromo-4-trifluoromethoxy benzene,pubchem2925,ksc496c0p PubChem CID: 2736418 IUPAC Name: 3-bromo-4-(trifluoromethoxy)aniline SMILES: C1=CC(=C(C=C1N)Br)OC(F)(F)F

PubChem CID 2736418
CAS 191602-54-7
Molecular Weight (g/mol) 256.022
MDL Number MFCD00190127
SMILES C1=CC(=C(C=C1N)Br)OC(F)(F)F
Synonym 3-bromo-4-trifluoromethoxy aniline,3-bromo-4-trifluoromethoxy benzenamine,4-amino-2-bromo trifluoromethoxy benzene,3-bromo-4-trifluoromethoxy-phenylamine,2-bromo-4-amino-trifluoromethoxybenzene,benzenamine, 3-bromo-4-trifluoromethoxy,1-amino-3-bromo-4-trifluoromethoxy benzene,pubchem2925,ksc496c0p
IUPAC Name 3-bromo-4-(trifluoromethoxy)aniline
InChI Key RAQMUBDHNKQNTD-UHFFFAOYSA-N
Molecular Formula C7H5BrF3NO
9,816

N-Phenylnicotinamide Hydrochloride 98.0+%, TCI America™

CAS: 69135-90-6 Molecular Formula: C12H11ClN2O Molecular Weight (g/mol): 234.683 MDL Number: MFCD00060194 InChI Key: SQFVWDGIESXVGY-UHFFFAOYSA-N Synonym: Nicotinanilide Hydrochloride PubChem CID: 23296855 IUPAC Name: N-phenylpyridine-3-carboxamide;hydrochloride SMILES: C1=CC=C(C=C1)NC(=O)C2=CN=CC=C2.Cl

PubChem CID 23296855
CAS 69135-90-6
Molecular Weight (g/mol) 234.683
MDL Number MFCD00060194
SMILES C1=CC=C(C=C1)NC(=O)C2=CN=CC=C2.Cl
Synonym Nicotinanilide Hydrochloride
IUPAC Name N-phenylpyridine-3-carboxamide;hydrochloride
InChI Key SQFVWDGIESXVGY-UHFFFAOYSA-N
Molecular Formula C12H11ClN2O
9,817

2,7-Dibromo-9,9-dipropylfluorene 98.0+%, TCI America™

CAS: 157771-56-7 Molecular Formula: C19H20Br2 Molecular Weight (g/mol): 408.18 MDL Number: MFCD12024280 InChI Key: QQTBEFPDRHYPLE-UHFFFAOYSA-N PubChem CID: 21924531 IUPAC Name: 2,7-dibromo-9,9-dipropyl-9H-fluorene SMILES: CCCC1(CCC)C2=C(C=CC(Br)=C2)C2=C1C=C(Br)C=C2

PubChem CID 21924531
CAS 157771-56-7
Molecular Weight (g/mol) 408.18
MDL Number MFCD12024280
SMILES CCCC1(CCC)C2=C(C=CC(Br)=C2)C2=C1C=C(Br)C=C2
IUPAC Name 2,7-dibromo-9,9-dipropyl-9H-fluorene
InChI Key QQTBEFPDRHYPLE-UHFFFAOYSA-N
Molecular Formula C19H20Br2
9,818

2,6-Dichloroanisole 98.0+%, TCI America™

CAS: 1984-65-2 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.02 MDL Number: MFCD00000575 InChI Key: KZLMCDNAVVJKPX-UHFFFAOYSA-N Synonym: 2,6-dichloroanisole,benzene, 1,3-dichloro-2-methoxy,2,6-dichloromethoxybenzene,2,6-dichloranisole,2,6-dichloranisol,benzene, 2,6-dichloro-1-methoxy,pubchem3682,acmc-1buci,ksc180o1t PubChem CID: 16127 IUPAC Name: 1,3-dichloro-2-methoxybenzene SMILES: COC1=C(Cl)C=CC=C1Cl

PubChem CID 16127
CAS 1984-65-2
Molecular Weight (g/mol) 177.02
MDL Number MFCD00000575
SMILES COC1=C(Cl)C=CC=C1Cl
Synonym 2,6-dichloroanisole,benzene, 1,3-dichloro-2-methoxy,2,6-dichloromethoxybenzene,2,6-dichloranisole,2,6-dichloranisol,benzene, 2,6-dichloro-1-methoxy,pubchem3682,acmc-1buci,ksc180o1t
IUPAC Name 1,3-dichloro-2-methoxybenzene
InChI Key KZLMCDNAVVJKPX-UHFFFAOYSA-N
Molecular Formula C7H6Cl2O
9,819

2-Iodotoluene (stabilized with Copper chip) 98.0+%, TCI America™

CAS: 615-37-2 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 MDL Number: MFCD00001042 InChI Key: RINOYHWVBUKAQE-UHFFFAOYSA-N Synonym: 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 PubChem CID: 5128 ChEBI: CHEBI:39813 IUPAC Name: 1-iodo-2-methylbenzene SMILES: CC1=CC=CC=C1I

PubChem CID 5128
CAS 615-37-2
Molecular Weight (g/mol) 218.037
ChEBI CHEBI:39813
MDL Number MFCD00001042
SMILES CC1=CC=CC=C1I
Synonym 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07
IUPAC Name 1-iodo-2-methylbenzene
InChI Key RINOYHWVBUKAQE-UHFFFAOYSA-N
Molecular Formula C7H7I
9,820

4-Bromo-N-methoxy-N-methylbenzamide 95.0+%, TCI America™

CAS: 192436-83-2 Molecular Formula: C9H10BrNO2 Molecular Weight (g/mol): 244.088 MDL Number: MFCD02684303 InChI Key: YEHZWOBPONLEEH-UHFFFAOYSA-N PubChem CID: 10999252 IUPAC Name: 4-bromo-N-methoxy-N-methylbenzamide SMILES: CN(C(=O)C1=CC=C(C=C1)Br)OC

PubChem CID 10999252
CAS 192436-83-2
Molecular Weight (g/mol) 244.088
MDL Number MFCD02684303
SMILES CN(C(=O)C1=CC=C(C=C1)Br)OC
IUPAC Name 4-bromo-N-methoxy-N-methylbenzamide
InChI Key YEHZWOBPONLEEH-UHFFFAOYSA-N
Molecular Formula C9H10BrNO2
9,821

N-(4-Aminobutyl)-5-chloronaphthalene-2-sulfonamide Hydrochloride 98.0+%, TCI America™

CAS: 88519-57-7 Molecular Formula: C14H18Cl2N2O2S Molecular Weight (g/mol): 349.27 MDL Number: MFCD00058030 InChI Key: QKAALLVQBOLELJ-UHFFFAOYSA-N Synonym: w-13 hydrochloride,n-4-aminobutyl-5-chloronaphthalene-2-sulfonamide hydrochloride,w-13, hydrochloride,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide hydrochloride,2-naphthalenesulfonamide,n-4-aminobutyl-5-chloro-, hydrochloride 1:1,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide, hcl,acmc-209qtx,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide hcl,n-4-aminobutyl-5-chloronaphthalene-2-sulfonamidehydrochloride,n-4-aminobutyl-5-chloro-2-naphthalene sulfonamide hydro chloride PubChem CID: 16760706 ChEBI: CHEBI:75367 IUPAC Name: N-(4-aminobutyl)-5-chloronaphthalene-2-sulfonamide;hydrochloride SMILES: C1=CC2=C(C=CC(=C2)S(=O)(=O)NCCCCN)C(=C1)Cl.Cl

PubChem CID 16760706
CAS 88519-57-7
Molecular Weight (g/mol) 349.27
ChEBI CHEBI:75367
MDL Number MFCD00058030
SMILES C1=CC2=C(C=CC(=C2)S(=O)(=O)NCCCCN)C(=C1)Cl.Cl
Synonym w-13 hydrochloride,n-4-aminobutyl-5-chloronaphthalene-2-sulfonamide hydrochloride,w-13, hydrochloride,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide hydrochloride,2-naphthalenesulfonamide,n-4-aminobutyl-5-chloro-, hydrochloride 1:1,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide, hcl,acmc-209qtx,n-4-aminobutyl-5-chloro-2-naphthalenesulfonamide hcl,n-4-aminobutyl-5-chloronaphthalene-2-sulfonamidehydrochloride,n-4-aminobutyl-5-chloro-2-naphthalene sulfonamide hydro chloride
IUPAC Name N-(4-aminobutyl)-5-chloronaphthalene-2-sulfonamide;hydrochloride
InChI Key QKAALLVQBOLELJ-UHFFFAOYSA-N
Molecular Formula C14H18Cl2N2O2S
9,822

2,4-Dichlorobenzoic Acid 97.0+%, TCI America™

CAS: 50-84-0 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.007 MDL Number: MFCD00002414 InChI Key: ATCRIUVQKHMXSH-UHFFFAOYSA-N Synonym: benzoic acid, 2,4-dichloro,2,4-dichlorobenzoesyre,2,4 dichlorobenzoic acid,2,4-dichloro-benzoic acid,2,4-dichlorobenzoicacid,ccris 9472,furosemide impurity e,pubchem21313,acmc-209kqh,wln: qvr bg dg PubChem CID: 5787 ChEBI: CHEBI:30748 IUPAC Name: 2,4-dichlorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)O

PubChem CID 5787
CAS 50-84-0
Molecular Weight (g/mol) 191.007
ChEBI CHEBI:30748
MDL Number MFCD00002414
SMILES C1=CC(=C(C=C1Cl)Cl)C(=O)O
Synonym benzoic acid, 2,4-dichloro,2,4-dichlorobenzoesyre,2,4 dichlorobenzoic acid,2,4-dichloro-benzoic acid,2,4-dichlorobenzoicacid,ccris 9472,furosemide impurity e,pubchem21313,acmc-209kqh,wln: qvr bg dg
IUPAC Name 2,4-dichlorobenzoic acid
InChI Key ATCRIUVQKHMXSH-UHFFFAOYSA-N
Molecular Formula C7H4Cl2O2
9,823

N-Carbobenzoxy-2-nitrobenzenesulfonamide 98.0+%, TCI America™

CAS: 245365-64-4 Molecular Formula: C14H12N2O6S Molecular Weight (g/mol): 336.318 MDL Number: MFCD06797080 InChI Key: BFQXFHUTPNBFSR-UHFFFAOYSA-N Synonym: N-Cbz-2-nitrobenzenesulfonamide PubChem CID: 10980593 IUPAC Name: benzyl N-(2-nitrophenyl)sulfonylcarbamate SMILES: C1=CC=C(C=C1)COC(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

PubChem CID 10980593
CAS 245365-64-4
Molecular Weight (g/mol) 336.318
MDL Number MFCD06797080
SMILES C1=CC=C(C=C1)COC(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]
Synonym N-Cbz-2-nitrobenzenesulfonamide
IUPAC Name benzyl N-(2-nitrophenyl)sulfonylcarbamate
InChI Key BFQXFHUTPNBFSR-UHFFFAOYSA-N
Molecular Formula C14H12N2O6S
9,824

3-Fluoro-5-(trifluoromethyl)benzaldehyde 98.0+%, TCI America™

CAS: 188815-30-7 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 MDL Number: MFCD00061312 InChI Key: UZZYXZWSOWQPIS-UHFFFAOYSA-N Synonym: 3-fluoro-5-trifluoromethyl benzaldehyde,3-fluoro-5-formylbenzotrifluoride,alpha,alpha,alpha,5-tetrafluoro-m-tolualdehyde,benzaldehyde, 3-fluoro-5-trifluoromethyl,pubchem4239,acmc-1bzt1,5-tetrafluoro-m-tolualdehyde,3-fluoro-5-trifluromethylbenzaldehyde PubChem CID: 605686 IUPAC Name: 3-fluoro-5-(trifluoromethyl)benzaldehyde SMILES: C1=C(C=C(C=C1C(F)(F)F)F)C=O

PubChem CID 605686
CAS 188815-30-7
Molecular Weight (g/mol) 192.113
MDL Number MFCD00061312
SMILES C1=C(C=C(C=C1C(F)(F)F)F)C=O
Synonym 3-fluoro-5-trifluoromethyl benzaldehyde,3-fluoro-5-formylbenzotrifluoride,alpha,alpha,alpha,5-tetrafluoro-m-tolualdehyde,benzaldehyde, 3-fluoro-5-trifluoromethyl,pubchem4239,acmc-1bzt1,5-tetrafluoro-m-tolualdehyde,3-fluoro-5-trifluromethylbenzaldehyde
IUPAC Name 3-fluoro-5-(trifluoromethyl)benzaldehyde
InChI Key UZZYXZWSOWQPIS-UHFFFAOYSA-N
Molecular Formula C8H4F4O
9,825

2-Chloro-4-phenylphenol 96.0+%, TCI America™

CAS: 92-04-6 Molecular Formula: C12H9ClO Molecular Weight (g/mol): 204.653 MDL Number: MFCD00045745 InChI Key: BZWMYDJJDBFAPE-UHFFFAOYSA-N Synonym: sanidril,4-phenyl-2-chlorophenol,3-chloro-4-hydroxybiphenyl,dowicide 4,3-chlorobiphenyl-4-ol,3-chloro-4-biphenylol,o-chloro-p-phenylphenol,2-chloro-p-phenylphenol,3-chloro-4-hydroxydiphenyl,phenol, 2-chloro-4-phenyl PubChem CID: 7074 IUPAC Name: 2-chloro-4-phenylphenol SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)O)Cl

PubChem CID 7074
CAS 92-04-6
Molecular Weight (g/mol) 204.653
MDL Number MFCD00045745
SMILES C1=CC=C(C=C1)C2=CC(=C(C=C2)O)Cl
Synonym sanidril,4-phenyl-2-chlorophenol,3-chloro-4-hydroxybiphenyl,dowicide 4,3-chlorobiphenyl-4-ol,3-chloro-4-biphenylol,o-chloro-p-phenylphenol,2-chloro-p-phenylphenol,3-chloro-4-hydroxydiphenyl,phenol, 2-chloro-4-phenyl
IUPAC Name 2-chloro-4-phenylphenol
InChI Key BZWMYDJJDBFAPE-UHFFFAOYSA-N
Molecular Formula C12H9ClO