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56771-29-0 | Pent-4-en-1-yltriphenylphosphonium bromide
CAS No: 56771-29-0 Catalog No: AG003BWL MDL No:MFCD00050215
Product Description
Catalog Number:
AG003BWL
Chemical Name:
Pent-4-en-1-yltriphenylphosphonium bromide
CAS Number:
56771-29-0
Molecular Formula:
C23H24BrP
Molecular Weight:
411.3144
MDL Number:
MFCD00050215
IUPAC Name:
pent-4-enyl(triphenyl)phosphanium;bromide
InChI:
InChI=1S/C23H24P.BrH/c1-2-3-13-20-24(21-14-7-4-8-15-21,22-16-9-5-10-17-22)23-18-11-6-12-19-23;/h2,4-12,14-19H,1,3,13,20H2;1H/q+1;/p-1
InChI Key:
KANICXDUFCDRDS-UHFFFAOYSA-M
SMILES:
C=CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
NSC Number:
245403
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.08g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
411.323g/mol
Monoisotopic Mass:
410.08g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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