200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 88072-89-3
88072-89-3 | 2,6-Tridecanedione, 5-methyl-5-nitro-
CAS No: 88072-89-3 Catalog No: AG004ETL MDL No:
Product Description
Catalog Number:
AG004ETL
Chemical Name:
2,6-Tridecanedione, 5-methyl-5-nitro-
CAS Number:
88072-89-3
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
IUPAC Name:
5-methyl-5-nitrotridecane-2,6-dione
InChI:
InChI=1S/C14H25NO4/c1-4-5-6-7-8-9-13(17)14(3,15(18)19)11-10-12(2)16/h4-11H2,1-3H3
InChI Key:
FIUUVZBJRGKRFH-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)C([N+](=O)[O-])(CCC(=O)C)C
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.357g/mol
Monoisotopic Mass:
271.178g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.