Basic information
- CAS
1886-01-7- Standard SMILES
COP(=O)(OC)SCC(Cl)(Cl)Cl- InChIKey
GNKLHIRYOZCFMO-UHFFFAOYSA-N- Molecular formula
- C4H8Cl3O3PS
- Average molar mass
- 273.5 g/mol
- Monoisotopic mass
- 271.899735
Names & identifiers
- Preferred name
- Ent 27272
- IUPAC
- 1,1,1-trichloro-2-dimethoxyphosphorylsulfanylethane
- English name
- Phosphorothioic acid O,O-dimethyl S-(2,2,2-trichloroethyl) ester
- Molecular weight
- 0
Names & synonyms
Chemagro 4675O,O-Dimethyl S-(2,2,2-trichloroethyl) phosphorothioate1886-01-7ENT 27,272BRN 2209435ENT 27272DTXSID00172231Phosphorothioic acid, O,O-dimethyl S-2,2,2-trichloroethyl esterRefChem:339610DTXCID6094722Phosphorothioic acid O,O-dimethyl S-(2,2,2-trichloroethyl) ester1,1,1-trichloro-2-dimethoxyphosphorylsulfanylethane
Show more names
ENT-27272
Database identifiers
- CAS
1886-01-7- PubChem CID
- 74673
- DTXSID
DTXSID00172231- Nikkaji
- J34.689F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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