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Home > Nitro Compounds > 6931-05-1
6931-05-1 | 2-Butanone, 3-methyl-3-nitroso- (6CI,7CI,8CI,9CI)
CAS No: 6931-05-1 Catalog No: AG00FLVF MDL No:
Product Description
Catalog Number:
AG00FLVF
Chemical Name:
2-Butanone, 3-methyl-3-nitroso- (6CI,7CI,8CI,9CI)
CAS Number:
6931-05-1
IUPAC Name:
3-methyl-3-nitrosobutan-2-one
InChI:
InChI=1S/C5H9NO2/c1-4(7)5(2,3)6-8/h1-3H3
InChI Key:
BNYBZCCLCWZWEM-UHFFFAOYSA-N
Properties
Complexity:
118
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:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
115.132g/mol
Monoisotopic Mass:
115.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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