Basic information
- CAS
82859-83-4- Standard SMILES
CCCCOC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl- InChIKey
LDFWPRWAZMXOKU-UHFFFAOYSA-N- Molecular formula
- C18H19Cl2NO2
- Average molar mass
- 352.3 g/mol
- Monoisotopic mass
- 351.0792842
Names & identifiers
- Preferred name
- Butyl 2-[(2,6-dichlorophenyl)amino]benzeneacetate
- IUPAC
- butyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
Names & synonyms
Butyl 2-[(2,6-dichlorophenyl)amino]benzeneacetateSCHEMBL13109329DTXSID10123223382859-83-4Butyl [2-(2,6-dichloroanilino)phenyl]acetate
Database identifiers
- CAS
82859-83-4- PubChem CID
- 59514932
- DTXSID
DTXSID101232233
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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