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127680-85-7 | 4-Pyridinecarbonitrile, 2-(dipropylamino)-
CAS No: 127680-85-7 Catalog No: AG000XA6 MDL No:
Product Description
Catalog Number:
AG000XA6
Chemical Name:
4-Pyridinecarbonitrile, 2-(dipropylamino)-
CAS Number:
127680-85-7
Molecular Formula:
C12H17N3
Molecular Weight:
203.2835
IUPAC Name:
2-(dipropylamino)pyridine-4-carbonitrile
InChI:
InChI=1S/C12H17N3/c1-3-7-15(8-4-2)12-9-11(10-13)5-6-14-12/h5-6,9H,3-4,7-8H2,1-2H3
InChI Key:
IEQZZRBCKFLPDL-UHFFFAOYSA-N
SMILES:
CCCN(c1nccc(c1)C#N)CCC
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.289g/mol
Monoisotopic Mass:
203.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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