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20543-49-1 | Phosphonium, bis(4-methoxyphenyl)diphenyl-, bromide (1:1)
CAS No: 20543-49-1 Catalog No: AG002A3G MDL No:
Product Description
Catalog Number:
AG002A3G
Chemical Name:
Phosphonium, bis(4-methoxyphenyl)diphenyl-, bromide (1:1)
CAS Number:
20543-49-1
Molecular Formula:
C26H24BrO2P
Molecular Weight:
479.3453
IUPAC Name:
bis(4-methoxyphenyl)-diphenylphosphanium;bromide
InChI:
InChI=1S/C26H24O2P.BrH/c1-27-21-13-17-25(18-14-21)29(23-9-5-3-6-10-23,24-11-7-4-8-12-24)26-19-15-22(28-2)16-20-26;/h3-20H,1-2H3;1H/q+1;/p-1
InChI Key:
AZYMIUYNGJOBSA-UHFFFAOYSA-M
SMILES:
COc1ccc(cc1)[P+](c1ccc(cc1)OC)(c1ccccc1)c1ccccc1.[Br-]
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
478.07g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
479.354g/mol
Monoisotopic Mass:
478.07g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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