Basic information
- CAS
917894-31-6- Standard SMILES
CCOC(=O)[C@@H](C)CN- InChIKey
XBEVGFLLWVWHCF-YFKPBYRVSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- Ethyl (2S)-3-amino-2-methylpropanoate
- IUPAC
- ethyl (2S)-3-amino-2-methylpropanoate
Names & synonyms
917894-31-6(S)-Ethyl 3-amino-2-methylpropanoateEthyl (2S)-3-amino-2-methylpropanoateDTXSID90649745EN300-7003983
Database identifiers
- CAS
917894-31-6- PubChem CID
- 25759534
- DTXSID
DTXSID90649745- Nikkaji
- J1.816.076E
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 93.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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