Basic information
- CAS
3735-81-7- Standard SMILES
COP(=O)(OC)OCC(Cl)(Cl)Cl- InChIKey
INWPVWWXVOWZDU-UHFFFAOYSA-N- Molecular formula
- C4H8Cl3O4P
- Average molar mass
- 257.43 g/mol
- Monoisotopic mass
- 255.922579
Names & identifiers
- Preferred name
- Phosphoric acid, dimethyl 2,2,2-trichloroethyl ester
- IUPAC
- dimethyl 2,2,2-trichloroethyl phosphate
- English name
- 1,1,1-trichloro-2-dimethoxyphosphoryloxy-ethane
- Molecular formula
- C4H8Cl3O4P
- Molecular weight
- 257.44
Names & synonyms
HipoderminTriclofos-methylDimethyl trichloroethyl phosphatePhosphoric acid, dimethyl 2,2,2-trichloroethyl esterBRN 5927790DTXSID20190795RefChem:370962DTXCID601132863735-81-7dimethyl 2,2,2-trichloroethyl phosphateSCHEMBL28861769Triclofos methyl
Show more names
DIMETHYL-2,2,2-TRICHLOROETHYLPHOSPHATE1,1,1-trichloro-2-dimethoxyphosphoryloxy-ethanePhosphoric acid 2,2,2-trichloroethyldimethyl esterPhosphoric acid dimethyl 2,2,2-trichloroethyl ester
Database identifiers
- CAS
3735-81-7- PubChem CID
- 145707
- DTXSID
DTXSID20190795- Nikkaji
- J96.827G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Boiling point
- 238.2 · 238.2±35.0 °C(Predicted)
- Density
- 1.496 · 1.496±0.06 g/cm3(Predicted)
- Toxicity
- 99 pph · mic-sat 99 pph SYSWAE 12,41,1979
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
- Toxicity
- mic-sat 99 pph SYSWAE 12,41,1979
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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