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100687-15-8

100687-15-8 | Phosphonium, [2-oxo-2-(2-propen-1-yloxy)ethyl]triphenyl-, chloride (1:1)

CAS No: 100687-15-8 Catalog No: AG0002N3 MDL No:MFCD08063243

Product Description

Catalog Number:
AG0002N3
Chemical Name:
Phosphonium, [2-oxo-2-(2-propen-1-yloxy)ethyl]triphenyl-, chloride (1:1)
CAS Number:
100687-15-8
Molecular Formula:
C23H22ClO2P
Molecular Weight:
396.8463
MDL Number:
MFCD08063243
IUPAC Name:
(2-oxo-2-prop-2-enoxyethyl)-triphenylphosphanium;chloride
InChI:
InChI=1S/C23H22O2P.ClH/c1-2-18-25-23(24)19-26(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22;/h2-17H,1,18-19H2;1H/q+1;/p-1
InChI Key:
WHJJJHBEYSCBFB-UHFFFAOYSA-M
SMILES:
C=CCOC(=O)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]

Properties

Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.105g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.851g/mol
Monoisotopic Mass:
396.105g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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