Ammonium, dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)phenyl-, methyl sulfate
Basic information
- CAS
41294-07-9- Standard SMILES
CCOP(C)(=O)SCC[N+](C)(C)c1ccccc1.COS(=O)(=O)[O-]- InChIKey
GIXDPYOACOYPDO-UHFFFAOYSA-M- Molecular formula
- C14H26NO6PS2
- Average molar mass
- 399.5 g/mol
- Monoisotopic mass
- 399.09391689
Names & identifiers
- Preferred name
- Ammonium, dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)phenyl-, methyl sulfate
- IUPAC
- 2-[ethoxy(methyl)phosphoryl]sulfanylethyl-dimethyl-phenylazanium;methyl sulfate
Names & synonyms
41294-07-9Dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)phenylammonium methyl sulfateAMMONIUM, DIMETHYL(2-((ETHOXYMETHYLPHOSPHINYL)THIO)ETHYL)PHENYL-, METHYL SULFATEBenzenaminium, N,N-dimethyl-N-(2-((ethoxymethylphosphinyl)thio)ethyl)-, methyl sulfateO-Ethyl-S-(2-(N-methyl-N-phenylamino)ethyl)methyl-thiophosphonate methylsulfomethylateRefChem:319304Benzenaminium, N,N-dimethyl-N-(2-((ethoxymethylphosphinyl)thio)ethyl)-, methyl sulfate (9CI)DTXSID80961600N-(2-{[ethoxy(methyl)phosphoryl]sulfanyl}ethyl)-N,N-dimethylanilinium methyl sulfate
Database identifiers
- CAS
41294-07-9- PubChem CID
- 38826
- DTXSID
DTXSID80961600
Properties
Computed structural properties
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 381
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Related reactions
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Compound notes
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