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116195-87-0 | Propanedinitrile, 2,2'-(2,5-pyridinediylidene)bis- (9CI)
CAS No: 116195-87-0 Catalog No: AG000BUW MDL No:
Product Description
Catalog Number:
AG000BUW
Chemical Name:
Propanedinitrile, 2,2'-(2,5-pyridinediylidene)bis- (9CI)
CAS Number:
116195-87-0
Molecular Formula:
C11H3N5
Molecular Weight:
205.1750
IUPAC Name:
2-[6-(dicyanomethylidene)pyridin-3-ylidene]propanedinitrile
InChI:
InChI=1S/C11H3N5/c12-3-9(4-13)8-1-2-11(16-7-8)10(5-14)6-15/h1-2,7H
InChI Key:
ACJWZQANACXMFF-UHFFFAOYSA-N
SMILES:
N#CC(=c1ccc(=C(C#N)C#N)cn1)C#N
Properties
Complexity:
612
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.039g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.18g/mol
Monoisotopic Mass:
205.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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