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88259-01-2 | 1,2-Benzenediamine, N-phenyl-N'-(triphenylphosphoranylidene)-
CAS No: 88259-01-2 Catalog No: AG004APO MDL No:
Product Description
Catalog Number:
AG004APO
Chemical Name:
1,2-Benzenediamine, N-phenyl-N'-(triphenylphosphoranylidene)-
CAS Number:
88259-01-2
Molecular Formula:
C30H25N2P
Molecular Weight:
444.5067
IUPAC Name:
N-phenyl-2-[(triphenyl-λ5-phosphanylidene)amino]aniline
InChI:
InChI=1S/C30H25N2P/c1-5-15-25(16-6-1)31-29-23-13-14-24-30(29)32-33(26-17-7-2-8-18-26,27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-24,31H
InChI Key:
YKYHKYDYZCPYDJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Nc1ccccc1N=P(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
569
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.176g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
444.518g/mol
Monoisotopic Mass:
444.176g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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