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Product Name: Benzamide,N-[cyano(methylthio)methyl]-4-nitro-
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31666-17-8

31666-17-8 structure

31666-17-8 structure

Name: Benzamide,N-[cyano(methylthio)methyl]-4-nitro-
Chemical Name: N-[cyano(methylsulfanyl)methyl]-4-nitrobenzamide
CAS Number: 31666-17-8
Molecular Formula: C₁₀H₉N₃O₃S
Molecular Weight: 251.26200
Create Date: 2017-08-22 18:47:36
Modify Date: 2025-09-07 17:24:29

Name	N-[cyano(methylsulfanyl)methyl]-4-nitrobenzamide

Density	1.377g/cm3
Boiling Point	472.1ºC at 760mmHg
Molecular Formula	C₁₀H₉N₃O₃S
Molecular Weight	251.26200
Flash Point	239.3ºC
Exact Mass	251.03600
PSA	124.01000
LogP	2.45138
Index of Refraction	1.613

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CV2510000

CHEMICAL NAME :: Benzamide, N-(cyano(methylthio)methyl)-p-nitro-

CAS REGISTRY NUMBER :: 31666-17-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C10-H9-N3-O3-S

MOLECULAR WEIGHT :: 251.28

WISWESSER LINE NOTATION :: WNR DVMYS1&CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 14,456,1971

31666-15-6 structure

31666-15-6

~%

31666-17-8 structure

31666-17-8

Literature: Shah; Lam; Ketcham Journal of medicinal chemistry, 1971 , vol. 14, # 5 p. 456 - 458

Precursor 1
31666-15-6
DownStream 0

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