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93383-33-6 | Phosphonic acid, [phenyl[(phenylmethyl)sulfinyl]methyl]-, diethyl ester
CAS No: 93383-33-6 Catalog No: AG006G73 MDL No:
Product Description
Catalog Number:
AG006G73
Chemical Name:
Phosphonic acid, [phenyl[(phenylmethyl)sulfinyl]methyl]-, diethyl ester
CAS Number:
93383-33-6
Molecular Formula:
C18H23O4PS
Molecular Weight:
366.4116
IUPAC Name:
[diethoxyphosphoryl(phenyl)methyl]sulfinylmethylbenzene
InChI:
InChI=1S/C18H23O4PS/c1-3-21-23(19,22-4-2)18(17-13-9-6-10-14-17)24(20)15-16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3
InChI Key:
JNQPLKKLZUGYLI-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(c1ccccc1)S(=O)Cc1ccccc1)OCC
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.105g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.412g/mol
Monoisotopic Mass:
366.105g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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