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117646-34-1 | 3-Quinolinylmalononitrile
CAS No: 117646-34-1 Catalog No: AG008XVU MDL No:
Product Description
Catalog Number:
AG008XVU
Chemical Name:
3-Quinolinylmalononitrile
CAS Number:
117646-34-1
IUPAC Name:
2-quinolin-3-ylpropanedinitrile
InChI:
InChI=1S/C12H7N3/c13-6-11(7-14)10-5-9-3-1-2-4-12(9)15-8-10/h1-5,8,11H
InChI Key:
PDIXYIJUISURBN-UHFFFAOYSA-N
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.209g/mol
Monoisotopic Mass:
193.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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