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145932-17-8 | Phosphonium, [1-(benzoylamino)ethenyl]triphenyl-, perchlorate (1:1)
CAS No: 145932-17-8 Catalog No: AG001DJE MDL No:
Product Description
Catalog Number:
AG001DJE
Chemical Name:
Phosphonium, [1-(benzoylamino)ethenyl]triphenyl-, perchlorate (1:1)
CAS Number:
145932-17-8
Molecular Formula:
C27H23ClNO5P
Molecular Weight:
507.9020
IUPAC Name:
1-benzamidoethenyl(triphenyl)phosphanium;perchlorate
InChI:
InChI=1S/C27H22NOP.ClHO4/c1-22(28-27(29)23-14-6-2-7-15-23)30(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26;2-1(3,4)5/h2-21H,1H2;(H,2,3,4,5)
InChI Key:
MFSBLSDQFUGINS-UHFFFAOYSA-N
SMILES:
[O-][Cl](=O)(=O)=O.O=C(c1ccccc1)NC(=C)[P+](c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
614
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
507.1g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
507.907g/mol
Monoisotopic Mass:
507.1g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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