Basic information
- CAS
6942-23-0- Standard SMILES
CCN(CC)C(=O)CCCCC(=O)OC- InChIKey
AFYZDHZQDQAGMM-UHFFFAOYSA-N- Molecular formula
- C11H21NO3
- Average molar mass
- 215.29 g/mol
- Monoisotopic mass
- 215.15214353
Names & identifiers
- Preferred name
- Methyl 6-(diethylamino)-6-oxohexanoate
- IUPAC
- methyl 6-(diethylamino)-6-oxohexanoate
Names & synonyms
6942-23-0methyl 6-(diethylamino)-6-oxohexanoateNSC57424SCHEMBL29191971DTXSID80288743NSC-57424DS-011457METHYL 5-(DIETHYLCARBAMOYL)PENTANOATE
Database identifiers
- CAS
6942-23-0- PubChem CID
- 245463
- DTXSID
DTXSID80288743
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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