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23072-03-9 | Phosphonium, triphenyl[2-(1-pyrrolidinyl)ethyl]-, bromide (1:1)
CAS No: 23072-03-9 Catalog No: AG002M4H MDL No:
Product Description
Catalog Number:
AG002M4H
Chemical Name:
Phosphonium, triphenyl[2-(1-pyrrolidinyl)ethyl]-, bromide (1:1)
CAS Number:
23072-03-9
Molecular Formula:
C24H27BrNP
Molecular Weight:
440.3556
IUPAC Name:
triphenyl(2-pyrrolidin-1-ylethyl)phosphanium;bromide
InChI:
InChI=1S/C24H27NP.BrH/c1-4-12-22(13-5-1)26(23-14-6-2-7-15-23,24-16-8-3-9-17-24)21-20-25-18-10-11-19-25;/h1-9,12-17H,10-11,18-21H2;1H/q+1;/p-1
InChI Key:
HKLRVZSQJCQGQN-UHFFFAOYSA-M
SMILES:
C1CCN(C1)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
EC Number:
607-195-7
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.106g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
440.365g/mol
Monoisotopic Mass:
439.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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