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14551-68-9 | 4-Pentenenitrile, 5,5-diphenyl-
CAS No: 14551-68-9 Catalog No: AG001D57 MDL No:
Product Description
Catalog Number:
AG001D57
Chemical Name:
4-Pentenenitrile, 5,5-diphenyl-
CAS Number:
14551-68-9
Molecular Formula:
C17H15N
Molecular Weight:
233.3077
IUPAC Name:
5,5-diphenylpent-4-enenitrile
InChI:
InChI=1S/C17H15N/c18-14-8-7-13-17(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-13H,7-8H2
InChI Key:
OJMNEELZNJFJDV-UHFFFAOYSA-N
SMILES:
N#CCCC=C(c1ccccc1)c1ccccc1
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.314g/mol
Monoisotopic Mass:
233.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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