Basic information
- CAS
4891-54-7- Standard SMILES
CCOP(=S)(OCC)OCCS(=O)(=O)CC- InChIKey
GZJFADYLHPWSII-UHFFFAOYSA-N- Molecular formula
- C8H19O5PS2
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.04115305
Names & identifiers
- Preferred name
- Demeton-o sulfone
- IUPAC
- diethoxy-(2-ethylsulfonylethoxy)-sulfanylidene-λ5-phosphane
- English name
- Demeton-O-sulfone
- Molecular formula
- C8H19O5PS2
- Molecular weight
- 290.34
Names & synonyms
Demeton-o sulfoneSystox sulfoneUNII-F9898N1EQ5BRN 1713537F9898N1EQ5Phosphorothioic acid, O,O-diethyl O-(2-(ethylsulfonyl)ethyl) esterDTXSID701976384-01-00-02447 (Beilstein Handbook Reference)Phosphorothioic acid, O,O-diethyl O-[2-(ethylsulfonyl)ethyl] esterRefChem:131777DTXCID30120129GZJFADYLHPWSII-UHFFFAOYSA-N
Show more names
O,O-Diethyl O-[2-(ethylsulfonyl)ethyl] =phosphorothioateThiophosphoric acid O,O-diethyl O-[2-(ethylsulfonyl)ethyl] ester
DEMETON-O-SULFONEDemeton-sulfone4891-54-7THIONODEMETON SULFONEDiethyl 2-ethylsulfonylethyl thionophosphateO,O-Diethyl 2-ethylmercaptoethyl thiophosphate, thiono isomerO,O-Diethyl-O-(2-ethylsulfonylethyl)phosphorothioateEthanol, 2-(ethylsulfonyl)-, O-ester with O,O-diethyl phosphorothioate
Database identifiers
- CAS
4891-54-7- PubChem CID
- 21007
- DTXSID
DTXSID70197638- UNII
- F9898N1EQ5
- Nikkaji
- J53.826D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Boiling point
- 145 °C · 145 °C(Press: 0.05 Torr)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- FDA UNII
- 9898 N1EQ5 · F9898N1EQ5
- RIDADR
- 3018 · 3018
- HazardClass
- 6.1 · 6.1(a)
- PackingGroup
- II
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
- ridadr
- 3018
- hazard_class
- 6.1(a)
- packing_group
- II
Chemistry & industry
Applications
UsesDemeton-O-sulfone is a useful research chemical compound is an organophosphorus pesticide.
Suppliers1 total
上海甄准生物科技有限公司15800340161 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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