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116203-81-7 | 2-Propanone, 1-[(2-methylpropyl)nitrosoamino]-
CAS No: 116203-81-7 Catalog No: AG000BWN MDL No:
Product Description
Catalog Number:
AG000BWN
Chemical Name:
2-Propanone, 1-[(2-methylpropyl)nitrosoamino]-
CAS Number:
116203-81-7
Molecular Formula:
C7H14N2O2
Molecular Weight:
158.1983
IUPAC Name:
N-(2-methylpropyl)-N-(2-oxopropyl)nitrous amide
InChI:
InChI=1S/C7H14N2O2/c1-6(2)4-9(8-11)5-7(3)10/h6H,4-5H2,1-3H3
InChI Key:
YZQXKYIKDREYKE-UHFFFAOYSA-N
SMILES:
O=NN(CC(=O)C)CC(C)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.106g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.201g/mol
Monoisotopic Mass:
158.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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