Basic information
- Standard SMILES
O=C(OCC(Cl)(Cl)Cl)c1ccccc1CBr- InChIKey
HKROVVNLFBYKLP-UHFFFAOYSA-N- Molecular formula
- C10H8BrCl3O2
- Average molar mass
- 346.4 g/mol
Names & identifiers
- Preferred name
- 2-Bromomethyl-benzoic acid 2,2,2-trichloro-ethyl ester
- IUPAC
- 2,2,2-trichloroethyl 2-(bromomethyl)benzoate
Names & synonyms
SCHEMBL979631HKROVVNLFBYKLP-UHFFFAOYSA-N2-bromomethyl-benzoic acid 2,2,2-trichloro-ethyl ester
Database identifiers
- PubChem CID
- 66865249
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 243
Related reactions
8 records
Linked notes
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