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14993-80-7 | 2-Pyridineacetonitrile, 6-methyl-
CAS No: 14993-80-7 Catalog No: AG001M5H MDL No:
Product Description
Catalog Number:
AG001M5H
Chemical Name:
2-Pyridineacetonitrile, 6-methyl-
CAS Number:
14993-80-7
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
IUPAC Name:
2-(6-methylpyridin-2-yl)acetonitrile
InChI:
InChI=1S/C8H8N2/c1-7-3-2-4-8(10-7)5-6-9/h2-4H,5H2,1H3
InChI Key:
UEBREBAKASRNDA-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)CC#N
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.069g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.166g/mol
Monoisotopic Mass:
132.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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