Basic information
- CAS
6032-95-7- Standard SMILES
COC(=O)CCCCCC1NC(=O)CS1- InChIKey
YRTVIABUQHSPAJ-UHFFFAOYSA-N- Molecular formula
- C10H17NO3S
- Average molar mass
- 231.31 g/mol
- Monoisotopic mass
- 231.09291458
Names & identifiers
- Preferred name
- 2-Thiazolidinehexanoic acid, 4-oxo-, methyl ester
- IUPAC
- methyl 6-(4-oxo-1,3-thiazolidin-2-yl)hexanoate
Names & synonyms
6032-95-72-Thiazolidinehexanoic acid, 4-oxo-, methyl esterRefChem:1064834Acidomycin methyl ester4-Oxo-2-thiazolidinehexanoic acid methyl esterBRN 0085755DTXSID90975733Methyl 6-(4-hydroxy-2,5-dihydro-1,3-thiazol-2-yl)hexanoate
Database identifiers
- CAS
6032-95-7- PubChem CID
- 201464
- DTXSID
DTXSID90975733- Nikkaji
- J59.627B
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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