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105899-95-4

105899-95-4 | Benzenesulfonamide, 4-cyano-N-(triphenylphosphoranylidene)-

CAS No: 105899-95-4 Catalog No: AG007WHG MDL No:

Product Description

Catalog Number:
AG007WHG
Chemical Name:
Benzenesulfonamide, 4-cyano-N-(triphenylphosphoranylidene)-
CAS Number:
105899-95-4
Molecular Formula:
C25H19N2O2PS
Molecular Weight:
442.4693
IUPAC Name:
4-cyano-N-(triphenyl-λ5-phosphanylidene)benzenesulfonamide
InChI:
InChI=1S/C25H19N2O2PS/c26-20-21-16-18-25(19-17-21)31(28,29)27-30(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19H
InChI Key:
WQIYICRZAFZEBH-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)S(=O)(=O)N=P(c1ccccc1)(c1ccccc1)c1ccccc1

Properties

Complexity:
731  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.09g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
442.473g/mol
Monoisotopic Mass:
442.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  

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