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64881-20-5 | 3-Pyridinecarboxamide,1-(cyanomethyl)-1,4-dihydro-(9CI)
CAS No: 64881-20-5 Catalog No: AG00F79V MDL No:
Product Description
Catalog Number:
AG00F79V
Chemical Name:
3-Pyridinecarboxamide,1-(cyanomethyl)-1,4-dihydro-(9CI)
CAS Number:
64881-20-5
IUPAC Name:
1-(cyanomethyl)-4H-pyridine-3-carboxamide
InChI:
InChI=1S/C8H9N3O/c9-3-5-11-4-1-2-7(6-11)8(10)12/h1,4,6H,2,5H2,(H2,10,12)
InChI Key:
CJNMRONJINFWBO-UHFFFAOYSA-N
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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