Ethyl 4-oxo-4-(pentylamino)butanoate
Basic information
- CAS
1339182-18-1- Standard SMILES
CCCCCNC(=O)CCC(=O)OCC- InChIKey
OUPREBJBYMUQLH-UHFFFAOYSA-N- Molecular formula
- C11H21NO3
- Average molar mass
- 215.29 g/mol
- Monoisotopic mass
- 215.15214353
Names & identifiers
- Preferred name
- Ethyl 4-oxo-4-(pentylamino)butanoate
- IUPAC
- ethyl 4-oxo-4-(pentylamino)butanoate
Names & synonyms
DTXSID701230209ethyl 4-oxo-4-(pentylamino)butanoateAKOS008928363Butanoic acid, 4-oxo-4-(pentylamino)-, ethyl ester1339182-18-1
Database identifiers
- CAS
1339182-18-1- PubChem CID
- 60635005
- DTXSID
DTXSID701230209
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 192
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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