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1620-76-4 | 2-Pyridinecarbonitrile, 4-methyl-
CAS No: 1620-76-4 Catalog No: AG001SLX MDL No:MFCD00128868
Product Description
Catalog Number:
AG001SLX
Chemical Name:
2-Pyridinecarbonitrile, 4-methyl-
CAS Number:
1620-76-4
Molecular Formula:
C7H6N2
Molecular Weight:
118.1359
MDL Number:
MFCD00128868
IUPAC Name:
4-methylpyridine-2-carbonitrile
InChI:
InChI=1S/C7H6N2/c1-6-2-3-9-7(4-6)5-8/h2-4H,1H3
InChI Key:
LQAWSWUFSHYCHP-UHFFFAOYSA-N
SMILES:
Cc1cc(ncc1)C#N
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.053g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.139g/mol
Monoisotopic Mass:
118.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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