200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 16067-01-9
16067-01-9 | 2-Octanone, 1-nitro-
CAS No: 16067-01-9 Catalog No: AG001S4K MDL No:
Product Description
Catalog Number:
AG001S4K
Chemical Name:
2-Octanone, 1-nitro-
CAS Number:
16067-01-9
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
IUPAC Name:
1-nitrooctan-2-one
InChI:
InChI=1S/C8H15NO3/c1-2-3-4-5-6-8(10)7-9(11)12/h2-7H2,1H3
InChI Key:
CRGCBMPLEALRLX-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)C[N+](=O)[O-]
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.212g/mol
Monoisotopic Mass:
173.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.