200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 19932-75-3
19932-75-3 | Heptanedinitrile, 4-methyl-4-nitro-
CAS No: 19932-75-3 Catalog No: AG002C1E MDL No:
Product Description
Catalog Number:
AG002C1E
Chemical Name:
Heptanedinitrile, 4-methyl-4-nitro-
CAS Number:
19932-75-3
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
IUPAC Name:
4-methyl-4-nitroheptanedinitrile
InChI:
InChI=1S/C8H11N3O2/c1-8(11(12)13,4-2-6-9)5-3-7-10/h2-5H2,1H3
InChI Key:
QLACOZCNAGCALL-UHFFFAOYSA-N
SMILES:
N#CCCC([N+](=O)[O-])(CCC#N)C
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.