chempirical

Ethion

C9H22O4P2S4CAS 563-12-2384.46 g/mol

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Properties

Molecular formula
C9H22O4P2S4
Molar mass
384.46 g/mol
Exact mass
383.9876 Da
Density
1.22 g/mL (at 20 °C)
Melting point
−13–12 °C
Boiling point
165 °C (at 0.3 Torr)
logP
5.01Crippen estimate
Polar surface area
36.9 Ų
H-bond donors / acceptors
0 / 8
Rotatable bonds
12

Identifiers

CAS number
563-12-2
SMILES
CCOP(=S)(OCC)SCSP(=S)(OCC)OCC
InChIKey
RIZMRRKBZQXFOY-UHFFFAOYSA-N
InChI
InChI=1S/C9H22O4P2S4/c1-5-10-14(16,11-6-2)18-9-19-15(17,12-7-3)13-8-4/h5-9H2,1-4H3

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Names and synonyms

21 names · show all
  • Phosphorodithioic acid, SP,SP′-methylene OP,OP,OP′,OP′-tetraethyl ester
  • Phosphorodithioic acid, S,S′-methylene O,O,O′,O′-tetraethyl ester
  • RP 8167
  • ENT 24,105
  • Diethion
  • Ethyl methylene phosphorodithioate ([(EtO)2P(S)S]2CH2)
  • Niagara 1240
  • Phosphotox E
  • Rodocid
  • Tetraethyl S,S′-methylene bis(phosphorothiolothionate)
  • O,O,O′,O′-Tetraethyl S,S′-methylene bis(phosphorodithioate)
  • Ethopaz
  • Nialate
  • Hylemox
  • Hylemax
  • Rodocide
  • Fosfatox E
  • Rhodocide
  • Ethiol 100
  • Match
  • Tomahawk

Work with Ethion

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Phorate298-02-273 % similar Terbufos13071-79-968 % similar Chlormephos24934-91-665 % similar Disulfoton298-04-459 % similar Carbophenothion786-19-654 % similar Dioxathion78-34-250 % similar Prothoate2275-18-546 % similar Mecarbam2595-54-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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