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89174-43-6 | Propanedinitrile, [4,6-diphenyl-1-(2-propenyl)-2(1H)-pyridinylidene]-
CAS No: 89174-43-6 Catalog No: AG00638K MDL No:
Product Description
Catalog Number:
AG00638K
Chemical Name:
Propanedinitrile, [4,6-diphenyl-1-(2-propenyl)-2(1H)-pyridinylidene]-
CAS Number:
89174-43-6
Molecular Formula:
C23H17N3
Molecular Weight:
335.4012
IUPAC Name:
2-(4,6-diphenyl-1-prop-2-enylpyridin-2-ylidene)propanedinitrile
InChI:
InChI=1S/C23H17N3/c1-2-13-26-22(19-11-7-4-8-12-19)14-20(18-9-5-3-6-10-18)15-23(26)21(16-24)17-25/h2-12,14-15H,1,13H2
InChI Key:
YSCHOBITUUSCKQ-UHFFFAOYSA-N
SMILES:
C=CCn1c(cc(cc1=C(C#N)C#N)c1ccccc1)c1ccccc1
Properties
Complexity:
704
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.41g/mol
Monoisotopic Mass:
335.142g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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