Diethyl 2-[(2,2-dichloroacetyl)-phenyl-amino]propanedioate
Basic information
- CAS
13277-53-7- Standard SMILES
CCOC(=O)C(C(=O)OCC)N(C(=O)C(Cl)Cl)c1ccccc1- InChIKey
LIMCZYYAMCUZMD-UHFFFAOYSA-N- Molecular formula
- C15H17Cl2NO5
- Average molar mass
- 362.2 g/mol
- Monoisotopic mass
- 361.048378
Names & identifiers
- Preferred name
- Diethyl 2-[(2,2-dichloroacetyl)-phenyl-amino]propanedioate
- IUPAC
- diethyl 2-(N-(2,2-dichloroacetyl)anilino)propanedioate
Names & synonyms
13277-53-7NSC174011DIETHYL 2-[(2,2-DICHLOROACETYL)-PHENYL-AMINO]PROPANEDIOATEDTXSID10306080NSC-174011DS-010777Diethyl [(dichloroacetyl)(phenyl)amino]propanedioateDiethyl (2,2-dichloro-N-phenylacetamido)propanedioate
Database identifiers
- CAS
13277-53-7- PubChem CID
- 299985
- DTXSID
DTXSID10306080
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
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Compound notes
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