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Home > Nitro Compounds > 89329-54-4
89329-54-4 | 3-Nonanone, 1-(2-methyl-1,3-dioxolan-2-yl)-2-nitro-
CAS No: 89329-54-4 Catalog No: AG003ZFK MDL No:
Product Description
Catalog Number:
AG003ZFK
Chemical Name:
3-Nonanone, 1-(2-methyl-1,3-dioxolan-2-yl)-2-nitro-
CAS Number:
89329-54-4
Molecular Formula:
C13H23NO5
Molecular Weight:
273.3254
IUPAC Name:
1-(2-methyl-1,3-dioxolan-2-yl)-2-nitrononan-3-one
InChI:
InChI=1S/C13H23NO5/c1-3-4-5-6-7-12(15)11(14(16)17)10-13(2)18-8-9-19-13/h11H,3-10H2,1-2H3
InChI Key:
AMUXZGPAIOKDJM-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)C([N+](=O)[O-])CC1(C)OCCO1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.329g/mol
Monoisotopic Mass:
273.158g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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