Basic information
- CAS
102292-93-3- Standard SMILES
O=C(O)[C@@H]1CS[C@H](c2cccc([N+](=O)[O-])c2)N1- InChIKey
SALHXESGFYVCIK-DTWKUNHWSA-N- Molecular formula
- C10H10N2O4S
- Average molar mass
- 254.26 g/mol
- Monoisotopic mass
- 254.03612798
Names & identifiers
- Preferred name
- (2R,4R)-2-(3-nitrophenyl)-1,3-thiazolidine-4-carboxylic acid
- IUPAC
- (2R,4R)-2-(3-nitrophenyl)-1,3-thiazolidine-4-carboxylic acid
Names & synonyms
DTXSID101185333(2R,4R)-2-(3-nitrophenyl)-1,3-thiazolidine-4-carboxylic acid4-Thiazolidinecarboxylic acid, 2-(3-nitrophenyl)-, (2R-cis)-102292-93-3
Database identifiers
- CAS
102292-93-3- PubChem CID
- 699376
- DTXSID
DTXSID101185333
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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