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Phosphonic acid, diethyl-, anhydride with diethyl phosphorothionate

HCID 252510
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Basic information

CAS
26263-51-4
Standard SMILES
CCOP(=O)(CC)OP(=S)(OCC)OCC
InChIKey
GJORXRHEYYLMEX-UHFFFAOYSA-N
Molecular formula
C8H20O5P2S
Average molar mass
290.26 g/mol
Monoisotopic mass
290.0506689

Names & identifiers

Preferred name
Phosphonic acid, diethyl-, anhydride with diethyl phosphorothionate
IUPAC
diethoxy-[ethoxy(ethyl)phosphoryl]oxy-sulfanylidene-λ5-phosphane

Names & synonyms

26263-51-4LW523EBU7HPhosphonic acid, diethyl-, anhydride with diethyl phosphorothionateNSC 74528UNII-LW523EBU7HNSC74528NSC-74528Phosphonic acid, ethyl-, monoethyl ester, anhydride with O,O-diethyl phosphorothioatePhosphonic acid, anhydride with diethyl phosphorothionatediethoxy-[ethoxy(ethyl)phosphoryl]oxy-thioxo-$l^{5}-phosphanePhosphonic acid, monoethyl ester, anhydride with O,O-diethyl phosphorothioate

Database identifiers

CAS
26263-51-4
PubChem CID
252510
UNII
LW523EBU7H

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
86.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
16
Formal charge
0
Complexity
274

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Compound notes

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