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Home > Nitro Compounds > 16395-81-6
16395-81-6 | Butanamide, N-methyl-N-nitroso-
CAS No: 16395-81-6 Catalog No: AG001UKH MDL No:
Product Description
Catalog Number:
AG001UKH
Chemical Name:
Butanamide, N-methyl-N-nitroso-
CAS Number:
16395-81-6
Molecular Formula:
C5H10N2O2
Molecular Weight:
130.1451
IUPAC Name:
N-methyl-N-nitrosobutanamide
InChI:
InChI=1S/C5H10N2O2/c1-3-4-5(8)7(2)6-9/h3-4H2,1-2H3
InChI Key:
XPQQMTYSKBRMIY-UHFFFAOYSA-N
SMILES:
CN(C(=O)CCC)N=O
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.074g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.147g/mol
Monoisotopic Mass:
130.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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