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1192356-22-1 | 2-Pyridinecarbonitrile, 6-(1-amino-1-methylethyl)-, hydrochloride (1:1)
CAS No: 1192356-22-1 Catalog No: AG000IF1 MDL No:MFCD18802793
Product Description
Catalog Number:
AG000IF1
Chemical Name:
2-Pyridinecarbonitrile, 6-(1-amino-1-methylethyl)-, hydrochloride (1:1)
CAS Number:
1192356-22-1
Molecular Formula:
C9H12ClN3
Molecular Weight:
197.6647
MDL Number:
MFCD18802793
IUPAC Name:
6-(2-aminopropan-2-yl)pyridine-2-carbonitrile;hydrochloride
InChI:
InChI=1S/C9H11N3.ClH/c1-9(2,11)8-5-3-4-7(6-10)12-8;/h3-5H,11H2,1-2H3;1H
InChI Key:
CXAJUSGXDCRAHY-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(n1)C(N)(C)C.Cl
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.666g/mol
Monoisotopic Mass:
197.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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