Basic information
- CAS
1069-69-8- Standard SMILES
CCOC(=O)CC[C@H](NC(C)=O)C(=O)[O-]- InChIKey
ZVRKBFMAKKDMCL-ZETCQYMHSA-M- Molecular formula
- C9H14NO5-
- Average molar mass
- 216.21 g/mol
- Monoisotopic mass
- 216.08719755
Names & identifiers
- Preferred name
- (2S)-2-Acetamido-5-ethoxy-5-oxopentanoate
- IUPAC
- (2S)-2-acetamido-5-ethoxy-5-oxopentanoate
Names & synonyms
(2S)-2-Acetamido-5-ethoxy-5-oxopentanoate1069-69-8DTXSID00653792
Database identifiers
- CAS
1069-69-8- PubChem CID
- 39733503
- DTXSID
DTXSID00653792
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- -1
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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