Basic information
- Standard SMILES
CCOC(=O)C(N)CSc1ccco1- InChIKey
AZKYWJVUPVLXHW-UHFFFAOYSA-N- Molecular formula
- C9H13NO3S
- Average molar mass
- 215.27 g/mol
- Monoisotopic mass
- 215.06161445
Names & identifiers
- Preferred name
- Ethyl 2-Amino-3-(2-furanylthio)propanoate
- IUPAC
- ethyl 2-amino-3-(furan-2-ylsulfanyl)propanoate
Names & synonyms
SCHEMBL9536332AZKYWJVUPVLXHW-UHFFFAOYSA-NEthyl 2-Amino-3-(2-furanylthio)propanoate
Database identifiers
- PubChem CID
- 20149579
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 90.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 189
Related reactions
2 records
Compound notes
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