S-[2-(4-Pyridyl)ethyl]Thiolactic Acid, Sodium Salt
Basic information
- CAS
1024357-58-1- Standard SMILES
CC(SCCc1ccncc1)C(=O)[O-].[Na+]- InChIKey
HXVCAZABVQXHNI-UHFFFAOYSA-M- Molecular formula
- C10H12NNaO2S
- Average molar mass
- 233.26 g/mol
- Monoisotopic mass
- 233.04864408
Names & identifiers
- Preferred name
- S-[2-(4-Pyridyl)ethyl]Thiolactic Acid, Sodium Salt
- IUPAC
- sodium 2-(2-pyridin-4-ylethylsulfanyl)propanoate
- English name
- S-[2-(4-Pyridyl)ethyl] thiolactic acid, sodium salt
- Molecular formula
- C10H12NNaO2S
- Molecular weight
- 233.26
Names & synonyms
1024357-58-1S-[2-(4-Pyridyl)ethyl]Thiolactic Acid, Sodium Saltsodium;2-(2-pyridin-4-ylethylsulfanyl)propanoateSodium 2-((2-(pyridin-4-yl)ethyl)thio)propanoateS-[2-(4-PYRIDYL)ETHYL] THIOLACTIC ACID, SODIUM SALTstarbld0007061AGN-PC-0LMEFMDTXSID70408195SODIUM 2-{[2-(PYRIDIN-4-YL)ETHYL]SULFANYL}PROPANOATE2-[[2-(4-Pyridinyl)ethyl]thio]propanoic Acid SodiuM Salt
Database identifiers
- CAS
1024357-58-1- PubChem CID
- 5086736
- DTXSID
DTXSID70408195
Properties
Computed structural properties
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 226 · 226-228°C
- solubility
- DMSO, Methanol, Water
- form
- Solid
- color
- White Crystalline
Chemistry & industry
Applications
UsesS-[2-(4-Pyridyl)ethyl]Thiolactic Acid, Sodium Salt (cas# 1024357-58-1) is a compound useful in organic synthesis.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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