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80845-33-6 | Phosphorane, bis(2,2-dimethylpropoxy)iodomethylphenyl-
CAS No: 80845-33-6 Catalog No: AG00516O MDL No:
Product Description
Catalog Number:
AG00516O
Chemical Name:
Phosphorane, bis(2,2-dimethylpropoxy)iodomethylphenyl-
CAS Number:
80845-33-6
Molecular Formula:
C17H29IO2P
Molecular Weight:
423.2892
IUPAC Name:
bis(2,2-dimethylpropoxy)-(iodomethyl)-phenylphosphanium
InChI:
InChI=1S/C17H29IO2P/c1-16(2,3)12-19-21(14-18,20-13-17(4,5)6)15-10-8-7-9-11-15/h7-11H,12-14H2,1-6H3/q+1
InChI Key:
SKPBXGYMBMBVRI-UHFFFAOYSA-N
SMILES:
ICP(c1ccccc1)(OCC(C)(C)C)OCC(C)(C)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.095g/mol
Formal Charge:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
423.295g/mol
Monoisotopic Mass:
423.095g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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