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650612-93-4 | Phosphonic acid, [(1E)-1-iodo-2-phenylethenyl]-, diethyl ester
CAS No: 650612-93-4 Catalog No: AG00H5W9 MDL No:
Product Description
Catalog Number:
AG00H5W9
Chemical Name:
Phosphonic acid, [(1E)-1-iodo-2-phenylethenyl]-, diethyl ester
CAS Number:
650612-93-4
Molecular Formula:
C12H16IO3P
Molecular Weight:
366.1319
IUPAC Name:
(2-diethoxyphosphoryl-2-iodoethenyl)benzene
InChI:
InChI=1S/C12H16IO3P/c1-3-15-17(14,16-4-2)12(13)10-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChI Key:
PRJHHIGGJGXMOV-UHFFFAOYSA-N
SMILES:
CCOP(=O)(/C(=C\c1ccccc1)/I)OCC
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.988g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.135g/mol
Monoisotopic Mass:
365.988g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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