N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide

Modify Date: 2025-08-25 19:59:51

N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide Structure
N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide structure
 Common Name N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide
CAS Number 31666-18-9 Molecular Weight 236.29000
Density 1.214g/cm3 Boiling Point 421.3ºC at 760mmHg
Molecular Formula C11H12N2O2S Melting Point N/A
MSDS N/A Flash Point 208.6ºC

 Names

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

 Chemical & Physical Properties

Density 1.214g/cm3
Boiling Point 421.3ºC at 760mmHg
Molecular Formula C11H12N2O2S
Molecular Weight 236.29000
Flash Point 208.6ºC
Exact Mass 236.06200
PSA 87.42000
LogP 2.02858
Index of Refraction 1.568
InChIKey ILYIOFPQHLMOBX-UHFFFAOYSA-N
SMILES COc1ccc(C(=O)NC(C#N)SC)cc1

 Synthetic Route

dimethyl ethanediimidothioate structure

dimethyl ethane...

CAS#:79844-63-6

4-Methoxybenzaldehyde structure

4-Methoxybenzal...

CAS#:123-11-5

~%

N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide Structure

N-[cyano(methyl...

CAS#:31666-18-9

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

 Precursor & DownStream

Precursor  2

DownStream  0

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Chemsrc provides CAS#:31666-18-9 MSDS, density, melting point, boiling point, structure, etc. Its name is N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide>> amp version: N-[cyano(methylsulfanyl)methyl]-4-methoxybenzamide

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