Basic information
- Standard SMILES
COC(=O)c1sc(Br)cc1OC(C)c1ccccc1Cl- InChIKey
ACXWARJUMJGUAS-UHFFFAOYSA-N- Molecular formula
- C14H12BrClO3S
- Average molar mass
- 375.7 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-3-[1-(2-chloro-phenyl)-ethoxy]-thiophene-2-carboxylic acid methyl ester
- IUPAC
- methyl 5-bromo-3-[1-(2-chlorophenyl)ethoxy]thiophene-2-carboxylate
Names & synonyms
SCHEMBL1373718ACXWARJUMJGUAS-UHFFFAOYSA-N5-bromo-3-[1-(2-chloro-phenyl)-ethoxy]-thiophene-2- carboxylic acid methyl ester945256-26-8DB-3064545-Bromo-3-[1-(2-chloro-phenyl)-ethoxy]-thiophene-2-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 58970494
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 344
Related reactions
9 records
Compound notes
Loading…