2,2,2-Trichloroethyl 2-bromoacetate
Basic information
- CAS
55110-70-8- Standard SMILES
O=C(CBr)OCC(Cl)(Cl)Cl- InChIKey
GEYYLJCQSBTPQO-UHFFFAOYSA-N- Molecular formula
- C4H4BrCl3O2
- Average molar mass
- 270.33 g/mol
- Monoisotopic mass
- 267.84603
Names & identifiers
- Preferred name
- 2,2,2-Trichloroethyl 2-bromoacetate
- IUPAC
- 2,2,2-trichloroethyl 2-bromoacetate
- English name
- Acetate, 2-bromo-,2,2,2-trichloroethyl ester
- Molecular formula
- C4H4BrCl3O2
- Molecular weight
- 270.34
Names & synonyms
2,2,2-trichloroethyl 2-bromoacetate55110-70-8DTXSID00324218RefChem:242427DTXCID802753352,2,2-Trichloroethyl bromoacetateNSC406052SCHEMBL2063825GEYYLJCQSBTPQO-UHFFFAOYSA-N2,2,2-Trichloroethyl bromoacetate #NSC-406052Acetate, 2-bromo-,2,2,2-trichloroethyl ester
Show more names
Acetic acid, 2-bromo-, 2,2,2-trichloroethyl ester
Database identifiers
- CAS
55110-70-8- PubChem CID
- 347391
- DTXSID
DTXSID00324218
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- Boiling point
- 308.9 · 308.9±37.0 °C(Predicted)
- Density
- 1.858 · 1.858±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…