Basic information
- CAS
5472-72-0- Standard SMILES
CCOC(=O)C(Cc1ccc(Cl)cc1Cl)(NC(C)=O)C(=O)OCC- InChIKey
UWNJQTCOLIEBCW-UHFFFAOYSA-N- Molecular formula
- C16H19Cl2NO5
- Average molar mass
- 376.2 g/mol
- Monoisotopic mass
- 375.0640281
Names & identifiers
- Preferred name
- Diethyl acetamido[(2,4-dichlorophenyl)methyl]propanedioate
- IUPAC
- diethyl 2-acetamido-2-[(2,4-dichlorophenyl)methyl]propanedioate
Names & synonyms
5472-72-0NSC 29452NSC29452Diethyl acetamido[(2,4-dichlorophenyl)methyl]propanedioateDTXSID90283047NSC-29452
Database identifiers
- CAS
5472-72-0- PubChem CID
- 232195
- DTXSID
DTXSID90283047
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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