Basic information
- Standard SMILES
CCCOC(=O)C(C)Nc1ccc(Cl)c(Cl)c1- InChIKey
IXKJOODEGKAPQR-UHFFFAOYSA-N- Molecular formula
- C12H15Cl2NO2
- Average molar mass
- 276.16 g/mol
Names & identifiers
- Preferred name
- Propyl 2-(3,4-dichloroanilino)propanoate
- IUPAC
- propyl 2-(3,4-dichloroanilino)propanoate
Names & synonyms
SCHEMBL4418421
Database identifiers
- PubChem CID
- 9838464
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 251
Related reactions
1 records
Compound notes
Loading…