Ethyl 2-[(3-ethoxy-3-oxopropyl)-methylamino]cyclohexane-1-carboxylate
Basic information
- CAS
92793-31-2- Standard SMILES
CCOC(=O)CCN(C)C1CCCCC1C(=O)OCC- InChIKey
XYRXXFUTNVWUFJ-UHFFFAOYSA-N- Molecular formula
- C15H27NO4
- Average molar mass
- 285.38 g/mol
- Monoisotopic mass
- 285.19400834
Names & identifiers
- Preferred name
- Ethyl 2-[(3-ethoxy-3-oxopropyl)-methylamino]cyclohexane-1-carboxylate
- IUPAC
- ethyl 2-[(3-ethoxy-3-oxopropyl)-methylamino]cyclohexane-1-carboxylate
Names & synonyms
92793-31-2NSC280750ethyl 2-[(3-ethoxy-3-oxopropyl)-methylamino]cyclohexane-1-carboxylateDTXSID90314123NSC-280750DS-000668Ethyl 2-[(3-ethoxy-3-oxopropyl)(methyl)amino]cyclohexane-1-carboxylateCyclohexanecarboxylicacid, 2-[(3-ethoxy-3-oxopropyl)methylamino]-, ethyl ester
Database identifiers
- CAS
92793-31-2- PubChem CID
- 322663
- DTXSID
DTXSID90314123
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 319
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Compound notes
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