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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 (67,623)
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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10,081 – 10,095 of 78,441 results
10,081

Sodium 9,10-Dimethoxyanthracene-2-sulfonate 98.0+%, TCI America™

CAS: 67580-39-6 Molecular Formula: C16H13NaO5S Molecular Weight (g/mol): 340.325 MDL Number: MFCD00042061 InChI Key: CBGQZXMEEWCJQD-UHFFFAOYSA-M Synonym: 9,10-Dimethoxyanthracene-2-sulfonic Acid Sodium Salt, IPA-DAS PubChem CID: 4145994 IUPAC Name: sodium;9,10-dimethoxyanthracene-2-sulfonate SMILES: COC1=C2C=CC(=CC2=C(C3=CC=CC=C31)OC)S(=O)(=O)[O-].[Na+]

PubChem CID 4145994
CAS 67580-39-6
Molecular Weight (g/mol) 340.325
MDL Number MFCD00042061
SMILES COC1=C2C=CC(=CC2=C(C3=CC=CC=C31)OC)S(=O)(=O)[O-].[Na+]
Synonym 9,10-Dimethoxyanthracene-2-sulfonic Acid Sodium Salt, IPA-DAS
IUPAC Name sodium;9,10-dimethoxyanthracene-2-sulfonate
InChI Key CBGQZXMEEWCJQD-UHFFFAOYSA-M
Molecular Formula C16H13NaO5S
10,082

alpha,alpha'-Dichloro-m-xylene 96.0+%, TCI America™

CAS: 626-16-4 Molecular Formula: C8H8Cl2 Molecular Weight (g/mol): 175.052 MDL Number: MFCD00000912 InChI Key: GRJWOKACBGZOKT-UHFFFAOYSA-N Synonym: 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro PubChem CID: 12275 IUPAC Name: 1,3-bis(chloromethyl)benzene SMILES: C1=CC(=CC(=C1)CCl)CCl

PubChem CID 12275
CAS 626-16-4
Molecular Weight (g/mol) 175.052
MDL Number MFCD00000912
SMILES C1=CC(=CC(=C1)CCl)CCl
Synonym 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro
IUPAC Name 1,3-bis(chloromethyl)benzene
InChI Key GRJWOKACBGZOKT-UHFFFAOYSA-N
Molecular Formula C8H8Cl2
10,083

3'-(Methylthio)acetanilide, TCI America™

CAS: 2524-78-9 Molecular Formula: C9H11NOS Molecular Weight (g/mol): 181.253 InChI Key: DFRHNWNBWOIBRW-UHFFFAOYSA-N Synonym: 3-Acetamidothioanisole PubChem CID: 291818 IUPAC Name: N-(3-methylsulfanylphenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)SC

PubChem CID 291818
CAS 2524-78-9
Molecular Weight (g/mol) 181.253
SMILES CC(=O)NC1=CC(=CC=C1)SC
Synonym 3-Acetamidothioanisole
IUPAC Name N-(3-methylsulfanylphenyl)acetamide
InChI Key DFRHNWNBWOIBRW-UHFFFAOYSA-N
Molecular Formula C9H11NOS
10,084

2-(Methylthio)benzoic Acid 98.0+%, TCI America™

CAS: 3724-10-5 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00029934 InChI Key: LWJQGKJCZOGGPJ-UHFFFAOYSA-N Synonym: 2-methylthio benzoic acid,benzoic acid, 2-methylthio,o-methylthio benzoic acid,benzoic acid, o-methylthio,2-methylsulfanyl benzoic acid,2-methylmercaptobenzoic acid,2-carboxyphenyl methyl sulfide,acide methyl-s-2-benzoique,2-methylmercapto benzoic acid,acide methyl-s-2-benzoique french PubChem CID: 19498 IUPAC Name: 2-methylsulfanylbenzoic acid SMILES: CSC1=CC=CC=C1C(=O)O

PubChem CID 19498
CAS 3724-10-5
Molecular Weight (g/mol) 168.21
MDL Number MFCD00029934
SMILES CSC1=CC=CC=C1C(=O)O
Synonym 2-methylthio benzoic acid,benzoic acid, 2-methylthio,o-methylthio benzoic acid,benzoic acid, o-methylthio,2-methylsulfanyl benzoic acid,2-methylmercaptobenzoic acid,2-carboxyphenyl methyl sulfide,acide methyl-s-2-benzoique,2-methylmercapto benzoic acid,acide methyl-s-2-benzoique french
IUPAC Name 2-methylsulfanylbenzoic acid
InChI Key LWJQGKJCZOGGPJ-UHFFFAOYSA-N
Molecular Formula C8H8O2S
10,085

Ethylene Glycol Mono-m-tolyl Ether 98.0+%, TCI America™

CAS: 13605-19-1 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00014035 InChI Key: FDBXUXVQIOQYIX-UHFFFAOYSA-N Synonym: 2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol PubChem CID: 83611 IUPAC Name: 2-(3-methylphenoxy)ethanol SMILES: CC1=CC(=CC=C1)OCCO

PubChem CID 83611
CAS 13605-19-1
Molecular Weight (g/mol) 152.193
MDL Number MFCD00014035
SMILES CC1=CC(=CC=C1)OCCO
Synonym 2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol
IUPAC Name 2-(3-methylphenoxy)ethanol
InChI Key FDBXUXVQIOQYIX-UHFFFAOYSA-N
Molecular Formula C9H12O2
10,086

5-Fluoro-2-methylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™

PubChem CID 2783190
CAS 163517-62-2
MDL Number MFCD03095047
Color White
Physical Form Crystalline Powder
TSCA No
IUPAC Name (5-fluoro-2-methylphenyl)boronic acid
InChI Key QKOJLMKWBRBZNQ-UHFFFAOYSA-N
Molecular Formula C7H8BFO2
Formula Weight 153.95
Melting Point 148°C
10,087

4-(4-Hydroxyphenyl)thiomorpholine 1,1-Dioxide 98.0+%, TCI America™

CAS: 103661-13-8 Molecular Formula: C10H13NO3S Molecular Weight (g/mol): 227.28 MDL Number: MFCD06797109 InChI Key: NSHOLIWPDBJMPT-UHFFFAOYSA-N Synonym: 4-(1,1-Dioxothiomorpholino)phenol, 4-Thiomorpholinophenol 1′C,1′C-Dioxide PubChem CID: 21845223 IUPAC Name: 4-(4-hydroxyphenyl)-1λ⁶-thiomorpholine-1,1-dione SMILES: OC1=CC=C(C=C1)N1CCS(=O)(=O)CC1

PubChem CID 21845223
CAS 103661-13-8
Molecular Weight (g/mol) 227.28
MDL Number MFCD06797109
SMILES OC1=CC=C(C=C1)N1CCS(=O)(=O)CC1
Synonym 4-(1,1-Dioxothiomorpholino)phenol, 4-Thiomorpholinophenol 1′C,1′C-Dioxide
IUPAC Name 4-(4-hydroxyphenyl)-1λ⁶-thiomorpholine-1,1-dione
InChI Key NSHOLIWPDBJMPT-UHFFFAOYSA-N
Molecular Formula C10H13NO3S
10,088

4-Bromo-2-chloro-1-iodobenzene 97.0+%, TCI America™

CAS: 31928-47-9 Molecular Formula: C6H3BrClI Molecular Weight (g/mol): 317.348 MDL Number: MFCD00079709 InChI Key: OHHKQBZOURGNLR-UHFFFAOYSA-N Synonym: 4-bromo-2-chloroiodobenzene,1-bromo-3-chloro-4-iodobenzene,benzene, 4-bromo-2-chloro-1-iodo,buttpark 34\07-78,4-bromo-2-chloro-1-iodo-benzene,pubchem3592,acmc-1cp6y,3-chloro-4-iodobromobenzene,ksc493m0p,4-bromo-2-chloro-iodobenzene PubChem CID: 2735547 IUPAC Name: 4-bromo-2-chloro-1-iodobenzene SMILES: C1=CC(=C(C=C1Br)Cl)I

PubChem CID 2735547
CAS 31928-47-9
Molecular Weight (g/mol) 317.348
MDL Number MFCD00079709
SMILES C1=CC(=C(C=C1Br)Cl)I
Synonym 4-bromo-2-chloroiodobenzene,1-bromo-3-chloro-4-iodobenzene,benzene, 4-bromo-2-chloro-1-iodo,buttpark 34\07-78,4-bromo-2-chloro-1-iodo-benzene,pubchem3592,acmc-1cp6y,3-chloro-4-iodobromobenzene,ksc493m0p,4-bromo-2-chloro-iodobenzene
IUPAC Name 4-bromo-2-chloro-1-iodobenzene
InChI Key OHHKQBZOURGNLR-UHFFFAOYSA-N
Molecular Formula C6H3BrClI
10,089

Pentacene (purified by sublimation), TCI America™

CAS: 135-48-8 Molecular Formula: C22H14 Molecular Weight (g/mol): 278.35 MDL Number: MFCD00003710 InChI Key: SLIUAWYAILUBJU-UHFFFAOYSA-N Synonym: benzo b naphthacene,lin-dibenzanthracene,lin-naphthoanthracene,2,3:6,7-dibenzanthracene,unii-9fqu5ha0uy,9fqu5ha0uy,pentacen-2-yl,pentacene,2,7-dibenzanthracene PubChem CID: 8671 ChEBI: CHEBI:33148 IUPAC Name: pentacene SMILES: C1=CC2=CC3=CC4=CC5=CC=CC=C5C=C4C=C3C=C2C=C1

PubChem CID 8671
CAS 135-48-8
Molecular Weight (g/mol) 278.35
ChEBI CHEBI:33148
MDL Number MFCD00003710
SMILES C1=CC2=CC3=CC4=CC5=CC=CC=C5C=C4C=C3C=C2C=C1
Synonym benzo b naphthacene,lin-dibenzanthracene,lin-naphthoanthracene,2,3:6,7-dibenzanthracene,unii-9fqu5ha0uy,9fqu5ha0uy,pentacen-2-yl,pentacene,2,7-dibenzanthracene
IUPAC Name pentacene
InChI Key SLIUAWYAILUBJU-UHFFFAOYSA-N
Molecular Formula C22H14
10,090

4-Hydroxy-3-nitrophenylarsonic Acid 98.0+%, TCI America™

CAS: 121-19-7 Molecular Formula: C6H6AsNO6 Molecular Weight (g/mol): 263.037 MDL Number: MFCD00007112 InChI Key: XMVJITFPVVRMHC-UHFFFAOYSA-N Synonym: roxarsone,3-nitro,ristat,4-hydroxy-3-nitrobenzenearsonic acid,aklomix-3,roxarson,ren-o-sal,3-nitro-10,3n4hpa,nitrophenolarsonic acid PubChem CID: 5104 ChEBI: CHEBI:35817 IUPAC Name: (4-hydroxy-3-nitrophenyl)arsonic acid SMILES: C1=CC(=C(C=C1[As](=O)(O)O)[N+](=O)[O-])O

PubChem CID 5104
CAS 121-19-7
Molecular Weight (g/mol) 263.037
ChEBI CHEBI:35817
MDL Number MFCD00007112
SMILES C1=CC(=C(C=C1[As](=O)(O)O)[N+](=O)[O-])O
Synonym roxarsone,3-nitro,ristat,4-hydroxy-3-nitrobenzenearsonic acid,aklomix-3,roxarson,ren-o-sal,3-nitro-10,3n4hpa,nitrophenolarsonic acid
IUPAC Name (4-hydroxy-3-nitrophenyl)arsonic acid
InChI Key XMVJITFPVVRMHC-UHFFFAOYSA-N
Molecular Formula C6H6AsNO6
10,091

Ethyl 3-Iodobenzoate 98.0+%, TCI America™

CAS: 58313-23-8 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD00044769 InChI Key: POGCXCWRMMXDAQ-UHFFFAOYSA-N Synonym: ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709 PubChem CID: 143542 IUPAC Name: ethyl 3-iodobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)I

PubChem CID 143542
CAS 58313-23-8
Molecular Weight (g/mol) 276.073
MDL Number MFCD00044769
SMILES CCOC(=O)C1=CC(=CC=C1)I
Synonym ethyl-3-iodobenzoate,3-iodobenzoic acid ethyl ester,benzoic acid, 3-iodo-, ethyl ester,ethyl m-iodobenzoate,m-iodobenzoic acid ethyl ester,pubchem3883,ethyl-3-iodo-benzoate,acmc-1aupw,ethyl 3-iodobenzoate,rarechem al bi 0709
IUPAC Name ethyl 3-iodobenzoate
InChI Key POGCXCWRMMXDAQ-UHFFFAOYSA-N
Molecular Formula C9H9IO2
10,092

Pentafluoroanisole 98.0+%, TCI America™

CAS: 389-40-2 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00000289 InChI Key: ZRQUIRABLIQJRI-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene PubChem CID: 67849 IUPAC Name: 1,2,3,4,5-pentafluoro-6-methoxybenzene SMILES: COC1=C(C(=C(C(=C1F)F)F)F)F

PubChem CID 67849
CAS 389-40-2
Molecular Weight (g/mol) 198.092
MDL Number MFCD00000289
SMILES COC1=C(C(=C(C(=C1F)F)F)F)F
Synonym 2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene
IUPAC Name 1,2,3,4,5-pentafluoro-6-methoxybenzene
InChI Key ZRQUIRABLIQJRI-UHFFFAOYSA-N
Molecular Formula C7H3F5O
10,093

2-Bromo-4-nitrotoluene 98.0+%, TCI America™

CAS: 7745-93-9 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007195 InChI Key: XFZFJQHXWJIBQV-UHFFFAOYSA-N Synonym: 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene PubChem CID: 82189 IUPAC Name: 2-bromo-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])Br

PubChem CID 82189
CAS 7745-93-9
Molecular Weight (g/mol) 216.034
MDL Number MFCD00007195
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])Br
Synonym 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene
IUPAC Name 2-bromo-1-methyl-4-nitrobenzene
InChI Key XFZFJQHXWJIBQV-UHFFFAOYSA-N
Molecular Formula C7H6BrNO2
10,094

N-(2,4-Dinitrophenyl)-L-alanine 98.0+%, TCI America™

CAS: 1655-52-3 Molecular Formula: C9H9N3O6 Molecular Weight (g/mol): 255.19 MDL Number: MFCD00038106 InChI Key: KKHLKORVTUUSBC-YFKPBYRVSA-N Synonym: N-Dnp-L-alanine, Dnp-Ala-OH PubChem CID: 5464517 IUPAC Name: (2S)-2-[(2,4-dinitrophenyl)amino]propanoic acid SMILES: C[C@H](NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O

PubChem CID 5464517
CAS 1655-52-3
Molecular Weight (g/mol) 255.19
MDL Number MFCD00038106
SMILES C[C@H](NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O
Synonym N-Dnp-L-alanine, Dnp-Ala-OH
IUPAC Name (2S)-2-[(2,4-dinitrophenyl)amino]propanoic acid
InChI Key KKHLKORVTUUSBC-YFKPBYRVSA-N
Molecular Formula C9H9N3O6
10,095

3-(tert-Butyldimethylsilyloxy)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

PubChem CID 3463029
CAS 261621-12-9
MDL Number MFCD03701505
Color White-Yellow
Physical Form Crystalline Powder
TSCA No
InChI Key RDQWADDNQONTLB-UHFFFAOYSA-N
Molecular Formula C12H21BO3Si
Formula Weight 252.19
Melting Point 91°C