4-Chlorophenyl 2-chloro-1,1,2-trifluoroethyl sulfide
Basic information
- CAS
26574-57-2- Standard SMILES
FC(Cl)C(F)(F)Sc1ccc(Cl)cc1- InChIKey
VQSRHBSKMJDEFM-UHFFFAOYSA-N- Molecular formula
- C8H5Cl2F3S
- Average molar mass
- 261.09 g/mol
- Monoisotopic mass
- 259.9441112
Names & identifiers
- Preferred name
- 4-Chlorophenyl 2-chloro-1,1,2-trifluoroethyl sulfide
- IUPAC
- 1-chloro-4-(2-chloro-1,1,2-trifluoroethyl)sulfanylbenzene
- English name
- Benzene,1-chloro-4-[(2-chloro-1,1,2-trifluoroethyl)thio]-
- Molecular formula
- C8H5Cl2F3S
- Molecular weight
- 261.0915096
Names & synonyms
4-CHLOROPHENYL 2-CHLORO-1,1,2-TRIFLUOROETHYL SULFIDERefChem:522017654-874-91-chloro-4-(2-chloro-1,1,2-trifluoroethyl)sulfanylbenzene26574-57-2NSC166421DTXSID20304592VQSRHBSKMJDEFM-UHFFFAOYSA-NAKOS024332618NSC-1664211-chloro-4-[(2-chloro-1,1,2-trifluoroethyl)sulfanyl]benzeneBenzene,1-chloro-4-[(2-chloro-1,1,2-trifluoroethyl)thio]-
Database identifiers
- CAS
26574-57-2- PubChem CID
- 296340
- DTXSID
DTXSID20304592- EC Number
- 654-874-9
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302-H413
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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Related reactions
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Compound notes
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