Ethyl 1-acetyl-5,5-dimethylpyrrolidine-2-carboxylate
Basic information
- CAS
1333222-18-6- Standard SMILES
CCOC(=O)C1CCC(C)(C)N1C(C)=O- InChIKey
BDEXMBDFQJSQJJ-UHFFFAOYSA-N- Molecular formula
- C11H19NO3
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.13649347
Names & identifiers
- Preferred name
- Ethyl 1-acetyl-5,5-dimethylpyrrolidine-2-carboxylate
- IUPAC
- ethyl 1-acetyl-5,5-dimethylpyrrolidine-2-carboxylate
- English name
- ethyl 1-acetyl-5,5-dimethylpyrrolidine-2-carboxylate
- Molecular formula
- C11H19NO3
- Molecular weight
- 213.27346
Names & synonyms
ethyl 1-acetyl-5,5-dimethylpyrrolidine-2-carboxylate1333222-18-6Ethyl1-acetyl-5,5-dimethylpyrrolidine-2-carboxylateDTXSID00745202Ethyl 1-acetyl-5,5-dimethylprolinate
Database identifiers
- CAS
1333222-18-6- PubChem CID
- 71304239
- DTXSID
DTXSID00745202
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 273
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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