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31238-20-7 | (2-Chloroethyl)triphenylphosphonium bromide
CAS No: 31238-20-7 Catalog No: AG003BMW MDL No:MFCD00051877
Product Description
Catalog Number:
AG003BMW
Chemical Name:
(2-Chloroethyl)triphenylphosphonium bromide
CAS Number:
31238-20-7
Molecular Formula:
C20H19BrClP
Molecular Weight:
405.6956
MDL Number:
MFCD00051877
IUPAC Name:
2-chloroethyl(triphenyl)phosphanium;bromide
InChI:
InChI=1S/C20H19ClP.BrH/c21-16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;/h1-15H,16-17H2;1H/q+1;/p-1
InChI Key:
HETXOZDAMZALJQ-UHFFFAOYSA-M
SMILES:
ClCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
EC Number:
250-527-7
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.01g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.7g/mol
Monoisotopic Mass:
404.01g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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