Basic information
- Standard SMILES
O=C(OCC1CCCCC1)c1ccc(Br)o1- InChIKey
GSXCGCCBMWUDQU-UHFFFAOYSA-N- Molecular formula
- C12H15BrO3
- Average molar mass
- 287.15 g/mol
Names & identifiers
- Preferred name
- Cyclohexylmethyl 5-bromofuran-2-carboxylate
- IUPAC
- cyclohexylmethyl 5-bromofuran-2-carboxylate
Names & synonyms
SCHEMBL15129146GSXCGCCBMWUDQU-UHFFFAOYSA-Ncyclohexylmethyl 5-bromofuran-2-carboxylate
Database identifiers
- PubChem CID
- 86694615
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 238
Related reactions
3 records
Compound notes
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