Basic information
- CAS
38527-96-7- Standard SMILES
CCCSP(=O)(OCC)Oc1ccc(C)cc1- InChIKey
OGSIZYMAFPTPTR-UHFFFAOYSA-N- Molecular formula
- C12H19O3PS
- Average molar mass
- 274.32 g/mol
- Monoisotopic mass
- 274.07925264
Names & identifiers
- Preferred name
- O-Ethyl O-(4-methylphenyl) S-propyl phosphorothioate
- IUPAC
- 1-[ethoxy(propylsulfanyl)phosphoryl]oxy-4-methylbenzene
- English name
- 1-(ethoxy-propylsulfanyl-phosphoryl)oxy-4-methyl-benzene
- Molecular formula
- C12H19O3PS
- Molecular weight
- 274.32
Names & synonyms
38527-96-7o-ethyl o-(4-methylphenyl) s-propyl phosphorothioateDTXSID90959396RefChem:1093656DTXCID201387273BRN 2334455Phosphorothioic acid, O-ethyl O-(4-methylphenyl) S-propyl esterO-Ethyl O-(4-methylphenyl) S-propylphosphorothioateDB-2499611-(Ethoxy-propylsulfanylphosphoryl)oxy-4-methylbenzene1-(ethoxy-propylsulfanyl-phosphoryl)oxy-4-methyl-benzene
Database identifiers
- CAS
38527-96-7- PubChem CID
- 217313
- DTXSID
DTXSID90959396
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Boiling point
- 351.4 · 351.4±35.0 °C(Predicted)
- Density
- 1.141 · 1.141±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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