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181130-14-3 | 2-Pyridinecarbonitrile, 5-(aminomethyl)-
CAS No: 181130-14-3 Catalog No: AG0022OV MDL No:MFCD08457627
Product Description
Catalog Number:
AG0022OV
Chemical Name:
2-Pyridinecarbonitrile, 5-(aminomethyl)-
CAS Number:
181130-14-3
Molecular Formula:
C7H7N3
Molecular Weight:
133.1506
MDL Number:
MFCD08457627
IUPAC Name:
5-(aminomethyl)pyridine-2-carbonitrile
InChI:
InChI=1S/C7H7N3/c8-3-6-1-2-7(4-9)10-5-6/h1-2,5H,3,8H2
InChI Key:
ZIFSWCUCJMIKQC-UHFFFAOYSA-N
SMILES:
NCc1ccc(nc1)C#N
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
133.154g/mol
Monoisotopic Mass:
133.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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