Basic information
- Standard SMILES
Cc1ccc(Cl)c(OC(=O)c2ccccc2)c1- InChIKey
ZSKJJDXGFSOHEK-UHFFFAOYSA-N- Molecular formula
- C14H11ClO2
- Average molar mass
- 246.69 g/mol
Names & identifiers
- Preferred name
- 3-Benzoyloxy-4-chlorotoluene
- IUPAC
- (2-chloro-5-methylphenyl) benzoate
Names & synonyms
3-benzoyloxy-4-chlorotolueneSCHEMBL2060065ZSKJJDXGFSOHEK-UHFFFAOYSA-NBenzoic Acid 2-chloro-5-methyl-phenyl Ester
Database identifiers
- PubChem CID
- 16749222
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
10 records
Linked notes
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