Basic information
- Standard SMILES
CCCC(=O)NCC(=O)OC- InChIKey
ZNLZIFQCWQWBDV-UHFFFAOYSA-N- Molecular formula
- C7H13NO3
- Average molar mass
- 159.18 g/mol
Names & identifiers
- Preferred name
- Butyrylamino-acetic acid methyl ester
- IUPAC
- methyl 2-(butanoylamino)acetate
Names & synonyms
SCHEMBL810809n-Butyrylglycine, methyl esterButyrylamino-acetic acid methyl esterAKOS003593785
Database identifiers
- PubChem CID
- 4777936
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 145
Related reactions
2 records
Compound notes
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