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Thioperoxydiphosphoric acid ([(HO)2P(S)]2S2), OP,OP,OP',OP'-tetraethyl ester

HCID 76179
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Basic information

CAS
2901-90-8
Standard SMILES
CCOP(=S)(OCC)SSP(=S)(OCC)OCC
InChIKey
PJRVPYZPSNFUPX-UHFFFAOYSA-N
Molecular formula
C8H20O4P2S4
Average molar mass
370.5 g/mol
Monoisotopic mass
369.9719678

Names & identifiers

Preferred name
Thioperoxydiphosphoric acid ([(HO)2P(S)]2S2), OP,OP,OP',OP'-tetraethyl ester
IUPAC
(diethoxyphosphinothioyldisulfanyl)-diethoxy-sulfanylidene-λ5-phosphane
English name
tetraethyl thioperoxydiphosphate
Molecular formula
C8H20O4P2S4
Molecular weight
370.45

Names & synonyms

2901-90-8Thioperoxydiphosphoric acid, tetraethyl esterEINECS 220-794-4Thioperoxydiphosphoric acid ([(HO)2P(S)]2S2), tetraethyl esterDTXSID9062691Thioperoxydiphosphoric acid (((HO)2P(S))2S2), tetraethyl esterThioperoxydiphosphoric acid (((HO)2P(S))2S2), OP,OP,OP',OP'-tetraethyl esterThioperoxydiphosphoric acid ([(HO)2P(S)]2S2), OP,OP,OP',OP'-tetraethyl esterRefChem:189597DTXCID9037905Tetraethyl thioperoxydiphosphateED8B8346WR
Show more names
Bis(diethoxyphosphinothioyl) persulfide
PJRVPYZPSNFUPX-UHFFFAOYSA-NBis(diethoxythiophosphoryl) disulfideNS00048206

Database identifiers

CAS
2901-90-8
PubChem CID
76179
DTXSID
DTXSID9062691
UNII
ED8B8346WR
EC Number
220-794-4
Nikkaji
J32.938J

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
152 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
11
Heavy atoms
18
Formal charge
0
Complexity
265

Physicochemical properties

Melting point
23 · 23-24 °C
Boiling point
148 · 148-149 °C(Press: 0.6 Torr)
Density
1.2549 g/cm³ · 1.2549 g/cm³
EPA Substance Registry System
2 P · Thioperoxydiphosphoric acid ([(HO)2P(S)]2S2), tetraethyl ester (2901-90-8)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationThioperoxydiphosphoric acid ([(HO)2P(S)]2S2), OP,OP,OP',OP'-tetraethyl ester: INACTIVE

Related reactions

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Compound notes

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