2-methyl-1-nitro-4-phenylsulfanylbenzene

Modify Date: 2025-10-02 16:42:34

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure
2-methyl-1-nitro-4-phenylsulfanylbenzene structure
Common Name 2-methyl-1-nitro-4-phenylsulfanylbenzene
CAS Number 60326-45-6 Molecular Weight 245.29700
Density N/A Boiling Point N/A
Molecular Formula C13H11NO2S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-methyl-1-nitro-4-phenylsulfanylbenzene
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C13H11NO2S
Molecular Weight 245.29700
Exact Mass 245.05100
PSA 71.12000
LogP 4.57760
InChIKey XNZIISMDVPNKIU-UHFFFAOYSA-N
SMILES Cc1cc(Sc2ccccc2)ccc1[N+](=O)[O-]

 Synthetic Route

~90%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Liu, Chuanzhi; Zang, Xufeng; Yu, Baohua; Yu, Xiaochun; Xu, Qing Synlett, 2011 , # 8 art. no. W03511ST, p. 1143 - 1148

~%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Merck and Co., Inc. Patent: US4287201 A1, 1981 ;

~94%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Allen, Darin A. Synthetic Communications, 1999 , vol. 29, # 3 p. 447 - 455

~%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Kimball; Floyd; Das; Hunt; Krapcho; Rovnyak; Duff; Lee; Moquin; Turk; Hedberg; Moreland; Brittain; McMullen; Normandin; Cucinotta Journal of Medicinal Chemistry, 1992 , vol. 35, # 4 p. 780 - 793

~%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Bourgeois; Henrion Bulletin de la Societe Chimique de France, 1932 , vol. <4> 51, p. 1416,1421

~%

2-methyl-1-nitro-4-phenylsulfanylbenzene Structure

2-methyl-1-nitr...

CAS#:60326-45-6

Literature: Bourgeois; Henrion Bulletin de la Societe Chimique de France, 1932 , vol. <4> 51, p. 1416,1421

 Synonyms

(3-methyl-4-nitro-phenyl)-phenyl sulfide
Benzene,2-methyl-1-nitro-4-(phenylthio)
(3-methyl-4-nitrophenyl)phenylthioether
2-nitro-5-phenylthiotoluene
(3-Methyl-4-nitro-phenyl)-phenyl-sulfid
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