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114108-84-8 | Phosphonic acid, P-[[(methylsulfonyl)oxy]methyl]-, diethyl ester
CAS No: 114108-84-8 Catalog No: AG000ALX MDL No:MFCD09838882
Product Description
Catalog Number:
AG000ALX
Chemical Name:
Phosphonic acid, P-[[(methylsulfonyl)oxy]methyl]-, diethyl ester
CAS Number:
114108-84-8
Molecular Formula:
C6H15O6PS
Molecular Weight:
246.2185
MDL Number:
MFCD09838882
IUPAC Name:
diethoxyphosphorylmethyl methanesulfonate
InChI:
InChI=1S/C6H15O6PS/c1-4-10-13(7,11-5-2)6-12-14(3,8)9/h4-6H2,1-3H3
InChI Key:
CFXHICSKKKWNKL-UHFFFAOYSA-N
SMILES:
CCOP(=O)(COS(=O)(=O)C)OCC
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.214g/mol
Monoisotopic Mass:
246.033g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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