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86539-22-2 | ETHYL 2,2-BIS(DIETHOXYPHOSPHORYLSULFANYL)ACETATE
CAS No: 86539-22-2 Catalog No: AG004LX2 MDL No:
Product Description
Catalog Number:
AG004LX2
Chemical Name:
ETHYL 2,2-BIS(DIETHOXYPHOSPHORYLSULFANYL)ACETATE
CAS Number:
86539-22-2
Molecular Formula:
C12H26O8P2S2
Molecular Weight:
424.4076
IUPAC Name:
ethyl 2,2-bis(diethoxyphosphorylsulfanyl)acetate
InChI:
InChI=1S/C12H26O8P2S2/c1-6-16-11(13)12(23-21(14,17-7-2)18-8-3)24-22(15,19-9-4)20-10-5/h12H,6-10H2,1-5H3
InChI Key:
FTOFSQSKZNUNHX-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(SP(=O)(OCC)OCC)SP(=O)(OCC)OCC
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.054g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
424.4g/mol
Monoisotopic Mass:
424.054g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
148A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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