Home Other Building Blocks S-METHYL-N,N-DIETHYLTHIOCARBAMATE

S-METHYL-N,N-DIETHYLTHIOCARBAMATE

CAS No.:
37174-63-3
Catalog Number:
AG00C94E
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C94E
Chemical Name:
S-METHYL-N,N-DIETHYLTHIOCARBAMATE
CAS Number:
37174-63-3
MDL Number:
MFCD00870025
IUPAC Name:
S-methyl N,N-diethylcarbamothioate
InChI:
InChI=1S/C6H13NOS/c1-4-7(5-2)6(8)9-3/h4-5H2,1-3H3
InChI Key:
AQTFQQHFHGBCPG-UHFFFAOYSA-N
UNII:
JMM80HR26F
Properties
Complexity:
91.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.072g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.236g/mol
Monoisotopic Mass:
147.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Antitubercular activity of disulfiram, an antialcoholism drug, against multidrug- and extensively drug-resistant Mycobacterium tuberculosis isolates. Antimicrobial agents and chemotherapy 20120801
Disulfiram metabolite S-methyl-N,N-diethylthiocarbamate quantitation in human plasma with reverse phase ultra performance liquid chromatography and mass spectrometry. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20120515
Properties