Basic information
- Standard SMILES
COC(=O)C(NC(=O)C1CCCS1)C(C)C- InChIKey
PZUXTBDHIHIEEL-UHFFFAOYSA-N- Molecular formula
- C11H19NO3S
- Average molar mass
- 245.34 g/mol
- Monoisotopic mass
- 245.10856464
Names & identifiers
- Preferred name
- Methyl 3-methyl-2-(thiolane-2-carbonylamino)butanoate
- IUPAC
- methyl 3-methyl-2-(thiolane-2-carbonylamino)butanoate
Names & synonyms
AKOS013487602
Database identifiers
- PubChem CID
- 64168570
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 268
Related reactions
1 records
Compound notes
Loading…