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81724-91-6 | (2-((OXO-1,2-DIPHENYLETHYLIDENE)HYDRAZONO)PROPYL)TRIPHENYLPHOSPHONIUM CHLORIDE
CAS No: 81724-91-6 Catalog No: AG005IZR MDL No:
Product Description
Catalog Number:
AG005IZR
Chemical Name:
(2-((OXO-1,2-DIPHENYLETHYLIDENE)HYDRAZONO)PROPYL)TRIPHENYLPHOSPHONIUM CHLORIDE
CAS Number:
81724-91-6
Molecular Formula:
C35H30ClN2OP
Molecular Weight:
561.0523
IUPAC Name:
2-[(2-oxo-1,2-diphenylethylidene)hydrazinylidene]propyl-triphenylphosphanium;chloride
InChI:
InChI=1S/C35H30N2OP.ClH/c1-28(36-37-34(29-17-7-2-8-18-29)35(38)30-19-9-3-10-20-30)27-39(31-21-11-4-12-22-31,32-23-13-5-14-24-32)33-25-15-6-16-26-33;/h2-26H,27H2,1H3;1H/q+1;/p-1
InChI Key:
DCXRHICLIGOLHG-UHFFFAOYSA-M
SMILES:
CC(=NN=C(C(=O)c1ccccc1)c1ccccc1)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
Properties
Complexity:
774
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
560.178g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
561.062g/mol
Monoisotopic Mass:
560.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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