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28981-33-1 | Phosphonium, [(diphenylphosphino)methyl]methyldiphenyl-, iodide (1:1)
CAS No: 28981-33-1 Catalog No: AG002V2G MDL No:
Product Description
Catalog Number:
AG002V2G
Chemical Name:
Phosphonium, [(diphenylphosphino)methyl]methyldiphenyl-, iodide (1:1)
CAS Number:
28981-33-1
Molecular Formula:
C26H25IP2
Molecular Weight:
526.3287
IUPAC Name:
diphenylphosphanylmethyl-methyl-diphenylphosphanium;iodide
InChI:
InChI=1S/C26H25P2.HI/c1-28(25-18-10-4-11-19-25,26-20-12-5-13-21-26)22-27(23-14-6-2-7-15-23)24-16-8-3-9-17-24;/h2-21H,22H2,1H3;1H/q+1;/p-1
InChI Key:
OBDGSGCCDAYOCO-UHFFFAOYSA-M
SMILES:
C[P+](c1ccccc1)(c1ccccc1)CP(c1ccccc1)c1ccccc1.[I-]
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
526.048g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
526.338g/mol
Monoisotopic Mass:
526.048g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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