Basic information
- CAS
23052-55-3- Standard SMILES
CCOP(=O)(OCC)OCCS(=O)CC- InChIKey
PNLYZBMNZPMLRI-UHFFFAOYSA-N- Molecular formula
- C8H19O5PS
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.06908187
Names & identifiers
- Preferred name
- Phosphoric acid, diethyl 2-(ethylsulfinyl)ethyl ester
- IUPAC
- diethyl 2-ethylsulfinylethyl phosphate
Names & synonyms
23052-55-3Phosphoric acid, diethyl 2-(ethylsulfinyl)ethyl esterRefChem:1095396BRN 1712523O,O-Diethyl O-(2-(ethylsulfinyl)ethyl) phosphateDTXSID709457322-(Ethanesulfinyl)ethyl diethyl phosphate
Database identifiers
- CAS
23052-55-3- PubChem CID
- 89981
- DTXSID
DTXSID70945732- Nikkaji
- J96.809I
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 81 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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