O-Ethyl O-isobutyl S-chloromethyl dithiophosphate
Basic information
- CAS
70140-81-7- Standard SMILES
CCOP(=S)(OCC(C)C)SCCl- InChIKey
LOMUNVGWRGSERU-UHFFFAOYSA-N- Molecular formula
- C7H16ClO2PS2
- Average molar mass
- 262.8 g/mol
- Monoisotopic mass
- 262.0017868
Names & identifiers
- Preferred name
- O-Ethyl O-isobutyl S-chloromethyl dithiophosphate
- IUPAC
- chloromethylsulfanyl-ethoxy-(2-methylpropoxy)-sulfanylidene-λ5-phosphane
Names & synonyms
O-Ethyl O-isobutyl S-chloromethyl dithiophosphate70140-81-7S-(Chloromethyl) O-ethyl O-(2-methylpropyl) phosphorodithioateCCRIS 1622DTXSID009903768496AC8TP3O-Ethyl-O-isobutyl-S-chloromethyldithiophosphateS-Chloromethyl O-ethyl O-(2-methylpropyl) phosphorodithioatePhosphorodithioic acid, S-(chloromethyl) O-ethyl O-(2-methylpropyl) ester
Database identifiers
- CAS
70140-81-7- PubChem CID
- 135463
- DTXSID
DTXSID00990376- UNII
- 8496AC8TP3
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 75.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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