Sulprophos os sulfone
Basic information
- CAS
42795-00-6- Standard SMILES
CCCSP(=O)(OCC)Oc1ccc(S(C)(=O)=O)cc1- InChIKey
WLTBFWPXSKENKQ-UHFFFAOYSA-N- Molecular formula
- C12H19O5PS2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.04115305
Names & identifiers
- Preferred name
- Sulprophos os sulfone
- IUPAC
- 1-[ethoxy(propylsulfanyl)phosphoryl]oxy-4-methylsulfonylbenzene
- English name
- SULPROFOS OXYGEN ANALOG SULFONE
- Molecular formula
- C12H19O5PS2
- Molecular weight
- 338.38
Names & synonyms
42795-00-6Sulprophos os sulfoneSulprofos oxygen analog sulfoneBolstar oxon sulfoneSulprofos oxon sulfoneSulprofos-sulfone-oxon4DQP776UAKWLTBFWPXSKENKQ-UHFFFAOYSA-NDTXSID701016607O-Ethyl O-[4-(methylsulfonyl)phenyl] S-propyl phosphorothioateO-Ethyl O-[4-(methylsulfonyl)phenyl] S-propyl thiophosphate #O-Ethyl O-[4-(methanesulfonyl)phenyl] S-propyl phosphorothioate
Show more names
Reaxys ID: 2007934sulprofos oxygen analogue sulfone
Phosphorothioic acid, O-ethyl O-[4-(methylsulfonyl)phenyl] S-propyl ester
Database identifiers
- CAS
42795-00-6- PubChem CID
- 599124
- DTXSID
DTXSID701016607- UNII
- 4DQP776UAK
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 424
Physicochemical properties
- RIDADR
- 3018 · 3018
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 3018
- hazard_class
- 6.1(b)
- packing_group
- III
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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