Basic information
- CAS
16315-51-8- Standard SMILES
CCSC1CCCCO1- InChIKey
FEXFEHVMYWGPSJ-UHFFFAOYSA-N- Molecular formula
- C7H14OS
- Average molar mass
- 146.25 g/mol
- Monoisotopic mass
- 146.07653624
Names & identifiers
- Preferred name
- 2-Ethylsulfanyloxane
- IUPAC
- 2-ethylsulfanyloxane
- English name
- 2-(Ethylthio)tetrahydro-2H-pyran
- Molecular formula
- C7H14OS
- Molecular weight
- 146.25
Names & synonyms
2-ethylsulfanyloxane2-(Ethylthio)tetrahydro-2H-pyran16315-51-82H-Pyran, 2-(ethylthio)tetrahydro-2-(ethylsulfanyl)oxane2-ethylthiotetrahydropyranSCHEMBL9035724SCHEMBL9038048SCHEMBL9038050DTXSID90337630FEXFEHVMYWGPSJ-UHFFFAOYSA-NEthyl tetrahydro-2H-pyran-2-yl sulfide #
Database identifiers
- CAS
16315-51-8- PubChem CID
- 543742
- DTXSID
DTXSID90337630- Nikkaji
- J113.965G
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 75.3
Physicochemical properties
- Boiling point
- 42 °C · 42 °C(Press: 2 Torr)
- Density
- 0.99 · 0.99±0.1 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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