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173443-43-1 | Phosphonic acid, P-[(4-iodophenyl)methyl]-, diethyl ester
CAS No: 173443-43-1 Catalog No: AG001YXL MDL No:MFCD09033365
Product Description
Catalog Number:
AG001YXL
Chemical Name:
Phosphonic acid, P-[(4-iodophenyl)methyl]-, diethyl ester
CAS Number:
173443-43-1
Molecular Formula:
C11H16IO3P
Molecular Weight:
354.1212
MDL Number:
MFCD09033365
IUPAC Name:
1-(diethoxyphosphorylmethyl)-4-iodobenzene
InChI:
InChI=1S/C11H16IO3P/c1-3-14-16(13,15-4-2)9-10-5-7-11(12)8-6-10/h5-8H,3-4,9H2,1-2H3
InChI Key:
ACYSYNIYTMHNSY-UHFFFAOYSA-N
SMILES:
CCOP(=O)(Cc1ccc(cc1)I)OCC
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.988g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.124g/mol
Monoisotopic Mass:
353.988g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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