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Home > Pyridines > 127680-87-9
127680-87-9 | 4-Pyridinecarbonitrile, 2-(1-pyrrolidinyl)-
CAS No: 127680-87-9 Catalog No: AG000XA4 MDL No:MFCD08435908
Product Description
Catalog Number:
AG000XA4
Chemical Name:
4-Pyridinecarbonitrile, 2-(1-pyrrolidinyl)-
CAS Number:
127680-87-9
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD08435908
IUPAC Name:
2-pyrrolidin-1-ylpyridine-4-carbonitrile
InChI:
InChI=1S/C10H11N3/c11-8-9-3-4-12-10(7-9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2
InChI Key:
POKSKCURNRHWPZ-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1)N1CCCC1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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