Diethyl[(3,4-dichlorophenyl)amino]propanedioate
Basic information
- CAS
6939-59-9- Standard SMILES
CCOC(=O)C(Nc1ccc(Cl)c(Cl)c1)C(=O)OCC- InChIKey
CJHSQFQFBBRLNQ-UHFFFAOYSA-N- Molecular formula
- C13H15Cl2NO4
- Average molar mass
- 320.16 g/mol
- Monoisotopic mass
- 319.0378133
Names & identifiers
- Preferred name
- Diethyl[(3,4-dichlorophenyl)amino]propanedioate
- IUPAC
- diethyl 2-(3,4-dichloroanilino)propanedioate
Names & synonyms
6939-59-9diethyl[(3,4-dichlorophenyl)amino]propanedioateNSC57066NCIOpen2_007431DTXSID40288648NSC-57066Diethyl (3,4-dichloroanilino)propanedioateDS-000659DIETHYL 2-[(3,4-DICHLOROPHENYL)AMINO]PROPANEDIOATE
Database identifiers
- CAS
6939-59-9- PubChem CID
- 245291
- DTXSID
DTXSID40288648- Nikkaji
- J3.616.878A
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…