Basic information
- CAS
5672-84-4- Standard SMILES
O=C(Oc1ccc(Br)cc1)C(F)(F)F- InChIKey
WNDACGMBVBWZGO-UHFFFAOYSA-N- Molecular formula
- C8H4BrF3O2
- Average molar mass
- 269.01 g/mol
- Monoisotopic mass
- 267.93468
Names & identifiers
- Preferred name
- Acetic acid, trifluoro-, 4-bromophenyl ester
- IUPAC
- (4-bromophenyl) 2,2,2-trifluoroacetate
Names & synonyms
4-Bromophenyl trifluoroacetatep-Bromophenyl trifluoroacetateAcetic acid, trifluoro-, 4-bromophenyl esterDTXSID2073354Acetic acid, trifluoro-, p-bromophenyl ester (7CI,8CI)RefChem:316733DTXCID10421065672-84-4(4-bromophenyl) 2,2,2-trifluoroacetate4-BROMOPHENYL 2,2,2-TRIFLUOROACETATE4-Bromophenyltrifluoroacetate4-Bromophenol, trifluoroacetate
Show more names
SCHEMBL8538472Acetic acid, trifluoro-, p-bromophenyl esterF098448
Database identifiers
- CAS
5672-84-4- PubChem CID
- 79754
- DTXSID
DTXSID2073354- Nikkaji
- J1.554.810J
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 209
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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