Basic information
- Standard SMILES
Cc1cccc(C(=O)OC2CCCC2)c1Br- InChIKey
KBOAGZZACBLRJT-UHFFFAOYSA-N- Molecular formula
- C13H15BrO2
- Average molar mass
- 283.16 g/mol
Names & identifiers
- Preferred name
- Cyclopentyl 2-bromo-3-methylbenzoate
- IUPAC
- cyclopentyl 2-bromo-3-methylbenzoate
Names & synonyms
cyclopentyl 2-bromo-3-methylbenzoate1319196-76-3SCHEMBL2228804KBOAGZZACBLRJT-UHFFFAOYSA-NDA-12375
Database identifiers
- PubChem CID
- 67325920
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Related reactions
1 records
Compound notes
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