200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 131747-36-9
131747-36-9 | 2-Pyridinecarbonitrile, 3-[(acetyloxy)methyl]-
CAS No: 131747-36-9 Catalog No: AG000ZNE MDL No:
Product Description
Catalog Number:
AG000ZNE
Chemical Name:
2-Pyridinecarbonitrile, 3-[(acetyloxy)methyl]-
CAS Number:
131747-36-9
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
IUPAC Name:
(2-cyanopyridin-3-yl)methyl acetate
InChI:
InChI=1S/C9H8N2O2/c1-7(12)13-6-8-3-2-4-11-9(8)5-10/h2-4H,6H2,1H3
InChI Key:
HFTYCPJXTBOSFA-UHFFFAOYSA-N
SMILES:
CC(=O)OCc1cccnc1C#N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.