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23308-83-0 | Phosphonium, [(2-nitrophenyl)methyl]triphenyl-, bromide (1:1)
CAS No: 23308-83-0 Catalog No: AG002MVC MDL No:MFCD04971966
Product Description
Catalog Number:
AG002MVC
Chemical Name:
Phosphonium, [(2-nitrophenyl)methyl]triphenyl-, bromide (1:1)
CAS Number:
23308-83-0
Molecular Formula:
C25H21BrNO2P
Molecular Weight:
478.3175
MDL Number:
MFCD04971966
IUPAC Name:
(2-nitrophenyl)methyl-triphenylphosphanium;bromide
InChI:
InChI=1S/C25H21NO2P.BrH/c27-26(28)25-19-11-10-12-21(25)20-29(22-13-4-1-5-14-22,23-15-6-2-7-16-23)24-17-8-3-9-18-24;/h1-19H,20H2;1H/q+1;/p-1
InChI Key:
ATURWXASWONPRT-UHFFFAOYSA-M
SMILES:
[O-][N+](=O)c1ccccc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
NSC Number:
226219
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
477.049g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
478.326g/mol
Monoisotopic Mass:
477.049g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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