{[(3-Chloro-1,1,1-trifluoropropan-2-yl)disulfanyl]methyl}benzene
Basic information
- CAS
111832-14-5- Standard SMILES
FC(F)(F)C(CCl)SSCc1ccccc1- InChIKey
UQEVMSRUQOUVLQ-UHFFFAOYSA-N- Molecular formula
- C10H10ClF3S2
- Average molar mass
- 286.8 g/mol
- Monoisotopic mass
- 285.9864548
Names & identifiers
- Preferred name
- {[(3-Chloro-1,1,1-trifluoropropan-2-yl)disulfanyl]methyl}benzene
- IUPAC
- [(3-chloro-1,1,1-trifluoropropan-2-yl)disulfanyl]methylbenzene
Names & synonyms
111832-14-5DTXSID80547049{[(3-Chloro-1,1,1-trifluoropropan-2-yl)disulfanyl]methyl}benzene
Database identifiers
- CAS
111832-14-5- PubChem CID
- 13699600
- DTXSID
DTXSID80547049
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 193
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Compound notes
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