ethyl (4R)-2-oxo-1,3-thiazolidine-4-carboxylate
Basic information
- CAS
98155-24-9- Standard SMILES
CCOC(=O)[C@@H]1CSC(=O)N1- InChIKey
YIXFAUAZZLBCMW-BYPYZUCNSA-N- Molecular formula
- C6H9NO3S
- Average molar mass
- 175.21 g/mol
- Monoisotopic mass
- 175.03031432
Names & identifiers
- Preferred name
- ethyl (4R)-2-oxo-1,3-thiazolidine-4-carboxylate
- IUPAC
- ethyl (4R)-2-oxo-1,3-thiazolidine-4-carboxylate
- English name
- ethyl (R)-(-)-2-oxo-4-thiazolidinecarboxylate
- Molecular formula
- C6H9NO3S
- Molecular weight
- 175.21
Names & synonyms
ethyl (4R)-2-oxo-1,3-thiazolidine-4-carboxylate98155-24-9DTXSID80333000RefChem:341788DTXCID70284092CHEMBL358857SCHEMBL6087635YIXFAUAZZLBCMW-BYPYZUCNSA-NAKOS024319696ethyl (4R)-2-oxothiazolidin-4-carboxylateethyl (4R)-2-oxothiazolidine-4-carboxylateST50412051
Show more names
ethyl (R)-(-)-2-oxo-4-thiazolidinecarboxylate(-)-2-oxothiazolidine-4-carboxylic acid ethyl ester4-Thiazolidinecarboxylic acid, 2-oxo-, ethyl ester, (4R)-
ethyl(4R)-2-oxo-1,3-thiazolidine-4-carboxylate2-Oxothiazolidine-4(R)-carboxylic acid ethyl esterETHYL (R)-(-)-2-OXO-4-THIAZOLIDINE-CARBOXYLATE
Database identifiers
- CAS
98155-24-9- PubChem CID
- 477571
- DTXSID
DTXSID80333000- ChEMBL
CHEMBL358857- Nikkaji
- J1.204.747I
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Melting point
- 167 · 167-168 °C
- Density
- 1.299 · 1.299±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.943 · 10.943±0.40(predicted)
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Related reactions
3 records
Compound notes
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