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1753-97-5

1753-97-5 | 1,2-Benzenediamine, N1,N2-bis(triphenylphosphoranylidene)-

CAS No: 1753-97-5 Catalog No: AG0020WP MDL No:

Product Description

Catalog Number:
AG0020WP
Chemical Name:
1,2-Benzenediamine, N1,N2-bis(triphenylphosphoranylidene)-
CAS Number:
1753-97-5
Molecular Formula:
C42H34N2P2
Molecular Weight:
628.6803
IUPAC Name:
triphenyl-[2-[(triphenyl-λ5-phosphanylidene)amino]phenyl]imino-λ5-phosphane
InChI:
InChI=1S/C42H34N2P2/c1-7-21-35(22-8-1)45(36-23-9-2-10-24-36,37-25-11-3-12-26-37)43-41-33-19-20-34-42(41)44-46(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-34H
InChI Key:
LPPJVOFEDUXLAC-UHFFFAOYSA-N
SMILES:
c1ccc(c(c1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1
NSC Number:
625192

Properties

Complexity:
828  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
628.22g/mol
Formal Charge:
0
Heavy Atom Count:
46  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
628.696g/mol
Monoisotopic Mass:
628.22g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11  

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