2-(Diethylamino)butanoic acid ethyl ester
Basic information
- CAS
37043-64-4- Standard SMILES
CCOC(=O)C(CC)N(CC)CC- InChIKey
QOMCCSFBJHLAFC-UHFFFAOYSA-N- Molecular formula
- C10H21NO2
- Average molar mass
- 187.28 g/mol
- Monoisotopic mass
- 187.15722891
Names & identifiers
- Preferred name
- 2-(Diethylamino)butanoic acid ethyl ester
- IUPAC
- ethyl 2-(diethylamino)butanoate
Names & synonyms
2-(Diethylamino)butanoic acid ethyl ester37043-64-4ethyl 2-(diethylamino)butanoateSCHEMBL25338592DTXSID00958214AKOS013986817
Database identifiers
- CAS
37043-64-4- PubChem CID
- 142127
- DTXSID
DTXSID00958214- Nikkaji
- J765.528B
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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