Basic information
- CAS
85117-85-7- Standard SMILES
CCOC(CSCC(F)(F)F)OCC- InChIKey
ZSWGNKLWMBBFOG-UHFFFAOYSA-N- Molecular formula
- C8H15F3O2S
- Average molar mass
- 232.27 g/mol
- Monoisotopic mass
- 232.07448538
Names & identifiers
- Preferred name
- 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane
- IUPAC
- 2-(2,2-diethoxyethylsulfanyl)-1,1,1-trifluoroethane
- English name
- 2-[(2,2-diethoxyethyl)thio]-1,1,1-trifluoroethane
- Molecular formula
- C8H15F3O2S
- Molecular weight
- 232.2637096
Names & synonyms
85117-85-72-[(2,2-DIETHOXYETHYL)THIO]-1,1,1-TRIFLUOROETHANEEINECS 285-635-32-((2,2-Diethoxyethyl)thio)-1,1,1-trifluoroethaneDTXSID30234230RefChem:83635DTXCID30156721285-635-3CD83QYN5M2ZSWGNKLWMBBFOG-UHFFFAOYSA-NNS000651342-[(2,2-Diethoxyethyl)sulfanyl]-1,1,1-trifluoroethane
Show more names
2-(2,2-diethoxyethylsulfanyl)-1,1,1-trifluoroethane
Ethane, 1,1-diethoxy-2-[(2,2,2-trifluoroethyl)thio]-Ethane, 2-[(2,2-diethoxyethyl)thio]-1,1,1-trifluoro-
Database identifiers
- CAS
85117-85-7- PubChem CID
- 3020366
- DTXSID
DTXSID30234230- UNII
- CD83QYN5M2
- EC Number
- 285-635-3
- Nikkaji
- J309.736F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 135
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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