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7170-22-1 | 2,4-Quinolinedicarbonitrile
CAS No: 7170-22-1 Catalog No: AG0063GO MDL No:
Product Description
Catalog Number:
AG0063GO
Chemical Name:
2,4-Quinolinedicarbonitrile
CAS Number:
7170-22-1
Molecular Formula:
C11H5N3
Molecular Weight:
179.1775
IUPAC Name:
quinoline-2,4-dicarbonitrile
InChI:
InChI=1S/C11H5N3/c12-6-8-5-9(7-13)14-11-4-2-1-3-10(8)11/h1-5H
InChI Key:
IUEFJVHKIKXFFH-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C#N)nc2c1cccc2
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.182g/mol
Monoisotopic Mass:
179.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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