Basic information
- Standard SMILES
C=CCNCC(=O)OCc1ccccc1.Cl- InChIKey
UNODTVCDQWMHIK-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO2
- Average molar mass
- 241.71 g/mol
Names & identifiers
- Preferred name
- N-allylglycine benzyl ester hydrochloride
- IUPAC
- benzyl 2-(prop-2-enylamino)acetate;hydrochloride
Names & synonyms
SCHEMBL17536385UNODTVCDQWMHIK-UHFFFAOYSA-NN-allylglycine benzyl ester hydrochloride
Database identifiers
- PubChem CID
- 86705337
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
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