EA 2192
Basic information
- CAS
73207-98-4- Standard SMILES
CC(C)N(CCSP(C)(=O)O)C(C)C- InChIKey
UOXJNGFFPMOZDM-UHFFFAOYSA-N- Molecular formula
- C9H22NO2PS
- Average molar mass
- 239.32 g/mol
- Monoisotopic mass
- 239.11088712
Names & identifiers
- Preferred name
- EA 2192
- IUPAC
- 2-[di(propan-2-yl)amino]ethylsulfanyl-methylphosphinic acid
- English name
- diisopropylaminoethyl methyl thiolophosphonate
- Molecular formula
- C9H22NO2PS
- Molecular weight
- 239.32
Names & synonyms
73207-98-4Diisopropylaminoethyl methyl thiolophosphonatePhosphonothioic acid, methyl-, S-(2-(bis(1-methylethyl)amino)ethyl) esterRefChem:920789EA 21922-[di(propan-2-yl)amino]ethylsulfanyl-methylphosphinic acid5J7SBT85UYCompound A42-(DI(PROPAN-2-YL)AMINO)ETHYLSULFANYL-METHYLPHOSPHINIC ACIDEA-2192UNII-5J7SBT85UYSCHEMBL1447440
Show more names
S-(DIISOPROPYLAMINOETHYL)METHYLPHOSPHONOTHIONATES-(2-DIISOPROPYLAMINOETHYL)METHYLPHOSPHONOTHIOICACIDMethylphosphonothioic acid S-(2-diisopropylaminoethyl) esterMethylthiophosphonic acid S-[2-(diisopropylamino)ethyl] esterMethylphosphonothioic acid S-[2-[bis(1-methylethyl)amino]ethyl] esterPhosphonothioic acid, P-methyl-, S-[2-[bis(1-methylethyl)amino]ethyl] ester
SCHEMBL4402147DTXSID00223454NS00125743Methylphosphonothioic acid, S-[2-(diisopropylamino)ethyl] esterS-(2-(Diisopropylamino)ethyl) hydrogen methylphosphonothioateS-[2-(Diisopropylamino)ethyl] hydrogen methylphosphonothioate #S-{2-[Di(propan-2-yl)amino]ethyl} hydrogen (S)-methylphosphonothioate
Database identifiers
- CAS
73207-98-4- PubChem CID
- 51760
- DTXSID
DTXSID00223454- UNII
- 5J7SBT85UY
- Nikkaji
- J364.329H
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 201
Physicochemical properties
- Boiling point
- 329.5 · 329.5±44.0 °C(Predicted)
- Density
- 1.084 · 1.084±0.06 g/cm3(Predicted)
- pka
- 1.92 · 1.92±0.50(Predicted)
- FDA UNII
- 5 J7SBT85UY · 5J7SBT85UY
Chemistry & industry
Upstream & downstream products
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