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74764-66-2 | 4-Pyridineacetonitrile,a-oxo-
CAS No: 74764-66-2 Catalog No: AG005HAA MDL No:
Product Description
Catalog Number:
AG005HAA
Chemical Name:
4-Pyridineacetonitrile,a-oxo-
CAS Number:
74764-66-2
Molecular Formula:
C7H4N2O
Molecular Weight:
132.1195
IUPAC Name:
pyridine-4-carbonyl cyanide
InChI:
InChI=1S/C7H4N2O/c8-5-7(10)6-1-3-9-4-2-6/h1-4H
InChI Key:
GZKKBMGXUJZHSS-UHFFFAOYSA-N
SMILES:
N#CC(=O)c1ccncc1
EC Number:
277-991-3
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.032g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.122g/mol
Monoisotopic Mass:
132.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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