Norvaline, butyl ester
Basic information
- Standard SMILES
CCCCOC(=O)C(N)CCC- InChIKey
QAISAROSTCULBL-UHFFFAOYSA-N- Molecular formula
- C9H19NO2
- Average molar mass
- 173.25 g/mol
- Monoisotopic mass
- 173.14157885
Names & identifiers
- Preferred name
- Norvaline, butyl ester
- IUPAC
- butyl 2-aminopentanoate
Names & synonyms
Norvaline, butyl esterSCHEMBL9028149SCHEMBL27870672QAISAROSTCULBL-UHFFFAOYSA-NDTXSID501370706
Database identifiers
- PubChem CID
- 6426992
- DTXSID
DTXSID501370706
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 126
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Related reactions
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Compound notes
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