200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 123846-65-1
123846-65-1 | 2-Pyridineacetonitrile, 3-nitro-
CAS No: 123846-65-1 Catalog No: AG000L5L MDL No:MFCD11848723
Product Description
Catalog Number:
AG000L5L
Chemical Name:
2-Pyridineacetonitrile, 3-nitro-
CAS Number:
123846-65-1
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
MDL Number:
MFCD11848723
IUPAC Name:
2-(3-nitropyridin-2-yl)acetonitrile
InChI:
InChI=1S/C7H5N3O2/c8-4-3-6-7(10(11)12)2-1-5-9-6/h1-2,5H,3H2
InChI Key:
ADKRHEANEZONBA-UHFFFAOYSA-N
SMILES:
N#CCc1ncccc1[N+](=O)[O-]
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.136g/mol
Monoisotopic Mass:
163.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.