Basic information
- CAS
7507-43-9- Standard SMILES
CCOC(=O)C(C)(C)C(=O)Nc1ccccc1- InChIKey
IGOWFHMKERRZNU-UHFFFAOYSA-N- Molecular formula
- C13H17NO3
- Average molar mass
- 235.28 g/mol
- Monoisotopic mass
- 235.1208434
Names & identifiers
- Preferred name
- Ethyl 3-anilino-2,2-dimethyl-3-oxopropanoate
- IUPAC
- ethyl 3-anilino-2,2-dimethyl-3-oxopropanoate
Names & synonyms
7507-43-9ethyl 3-anilino-2,2-dimethyl-3-oxopropanoateNSC407985DTXSID10324921NSC-407985
Database identifiers
- CAS
7507-43-9- PubChem CID
- 348598
- DTXSID
DTXSID10324921
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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