(1,2-Dibromo-1,2,2-trifluoroethyl)benzene
Basic information
- CAS
40193-72-4- Standard SMILES
FC(F)(Br)C(F)(Br)c1ccccc1- InChIKey
ZZYJTIGMBINNQL-UHFFFAOYSA-N- Molecular formula
- C8H5Br2F3
- Average molar mass
- 317.93 g/mol
- Monoisotopic mass
- 315.87101
Names & identifiers
- Preferred name
- (1,2-Dibromo-1,2,2-trifluoroethyl)benzene
- IUPAC
- (1,2-dibromo-1,2,2-trifluoroethyl)benzene
- English name
- 1,2-Dibromo-1,2,2-trifluoro-1-phenylethane
- Molecular formula
- C8H5Br2F3
- Molecular weight
- 317.93
Names & synonyms
40193-72-4(1,2-dibromo-1,2,2-trifluoroethyl)benzeneDTXSID10371617RefChem:204237DTXCID803226511,2-Dibromo-1,2,2-trifluoro-1-phenylethane(1,2-DIBROMOTRIFLUOROETHYL)BENZENE;1,2-DIBROMO-1,2,2-TRIFLUORO-1-PHENYLETHANE;(1,2-dibromo-1,2,2-trifluoroethyl)benzene(1,2-DIBROMOTRIFLUOROETHYL)BENZENEα,β-dibromo-α,β,β-trifluorostyreneBenzene, (1,2-dibromo-1,2,2-trifluoroethyl)-
Database identifiers
- CAS
40193-72-4- PubChem CID
- 2736803
- DTXSID
DTXSID10371617
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Boiling point
- 69 · 69/0.9mm
- Density
- 1.88 · 1.88
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2903998090 · 2903998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2903998090
- hazard_code
- Xi
- hazard_note
- Irritant
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Related reactions
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Compound notes
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