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101012-32-2 | 3-Pyridineacetonitrile, 2-chloro-
CAS No: 101012-32-2 Catalog No: AG0003JI MDL No:MFCD09923767
Product Description
Catalog Number:
AG0003JI
Chemical Name:
3-Pyridineacetonitrile, 2-chloro-
CAS Number:
101012-32-2
Molecular Formula:
C7H5ClN2
Molecular Weight:
152.5810
MDL Number:
MFCD09923767
IUPAC Name:
2-(2-chloropyridin-3-yl)acetonitrile
InChI:
InChI=1S/C7H5ClN2/c8-7-6(3-4-9)2-1-5-10-7/h1-2,5H,3H2
InChI Key:
DMWOJKQPJYWCCB-UHFFFAOYSA-N
SMILES:
Clc1ncccc1CC#N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.014g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.581g/mol
Monoisotopic Mass:
152.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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