Basic information
- Standard SMILES
COC(=O)c1ccc(Cl)cc1N=CC(C)C- InChIKey
YSBXOSXFBKRASX-UHFFFAOYSA-N- Molecular formula
- C12H14ClNO2
- Average molar mass
- 239.7 g/mol
Names & identifiers
- Preferred name
- Methyl 4-chloro-2-(2-methylpropylideneamino)benzoate
- IUPAC
- methyl 4-chloro-2-(2-methylpropylideneamino)benzoate
Names & synonyms
SCHEMBL9227104
Database identifiers
- PubChem CID
- 67799372
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 266
Related reactions
1 records
Compound notes
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