CAS 20306-75-6 | Butanamide, N-methyl-3-oxo- | CAS Number 20306-75-6

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20306-75-6 | Butanamide, N-methyl-3-oxo-

CAS No: 20306-75-6 Catalog No: AG0028O8 MDL No:MFCD00044026

Product Description

Catalog Number:

AG0028O8

Chemical Name:

Butanamide, N-methyl-3-oxo-

CAS Number:

20306-75-6

Molecular Formula:

C5H9NO2

Molecular Weight:

115.1305

MDL Number:

MFCD00044026

IUPAC Name:

N-methyl-3-oxobutanamide

InChI:

InChI=1S/C5H9NO2/c1-4(7)3-5(8)6-2/h3H2,1-2H3,(H,6,8)

InChI Key:

ATWLCPHWYPSRBQ-UHFFFAOYSA-N

SMILES:

CNC(=O)CC(=O)C

EC Number:

243-723-9

UNII:

PWE9P6V839

Properties

Complexity:

109

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

115.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

115.132g/mol

Monoisotopic Mass:

115.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6

Literature

Title	Journal
Disposition and metabolism of N,N-dimethylacetoacetamide in male F344 and Wistar-Han rats and female B6C3F1 mice.	Xenobiotica; the fate of foreign compounds in biological systems 20111101
TLC-spectrophometric separation and trace determination of monocrotophos and dichlorvos in enviromental and biological samples.	Journal of environmental science & engineering 20070401
Degradation of monocrotophos in soils.	Chemosphere 20060101