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1113-68-4

1113-68-4 | N-Acetyl-N-methylacetamide

CAS No: 1113-68-4 Catalog No: AG003T7C MDL No:MFCD00014968

Product Description

Catalog Number:
AG003T7C
Chemical Name:
N-Acetyl-N-methylacetamide
CAS Number:
1113-68-4
Molecular Formula:
C5H9NO2
Molecular Weight:
115.1305
MDL Number:
MFCD00014968
IUPAC Name:
N-acetyl-N-methylacetamide
InChI:
InChI=1S/C5H9NO2/c1-4(7)6(3)5(2)8/h1-3H3
InChI Key:
ZNQFZPCFVNOXJQ-UHFFFAOYSA-N
SMILES:
CN(C(=O)C)C(=O)C
EC Number:
214-207-0
UNII:
767UT09B3U

Properties

Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.063g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
115.132g/mol
Monoisotopic Mass:
115.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  

Literature

Title Journal
Oxidative geminal functionalization of organoboron compounds. Angewandte Chemie (International ed. in English) 20121029
Acylating agents as enzyme inhibitors and understanding their reactivity for drug design. Journal of medicinal chemistry 20020620

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