Phosphorothioic acid, O,O-dibutyl S-(2-(methylamino)-2-oxoethyl) ester
Basic information
- CAS
35841-71-5- Standard SMILES
CCCCOP(=O)(OCCCC)SCC(=O)NC- InChIKey
DVMXTSBDEMQZKH-UHFFFAOYSA-N- Molecular formula
- C11H24NO4PS
- Average molar mass
- 297.35 g/mol
- Monoisotopic mass
- 297.11636642
Names & identifiers
- Preferred name
- Phosphorothioic acid, O,O-dibutyl S-(2-(methylamino)-2-oxoethyl) ester
- IUPAC
- 2-dibutoxyphosphorylsulfanyl-N-methylacetamide
Names & synonyms
BRN 2277316Phosphorothioic acid, O,O-dibutyl S-(2-(methylamino)-2-oxoethyl) ester35841-71-5O,O-Di-n-butyl S-(N-methylcarbamoylmethyl) phosphorothiolateDTXSID60189380RefChem:371252DTXCID90111871o,o-dibutyl s-[2-(methylamino)-2-oxoethyl] phosphorothioate
Database identifiers
- CAS
35841-71-5- PubChem CID
- 215555
- DTXSID
DTXSID60189380
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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