8H-Indeno[1,2-d]thiazole-5-carboxylic acid
Basic information
- CAS
1245648-00-3- Standard SMILES
O=C(O)c1ccc2c(c1)-c1ncsc1C2- InChIKey
LTORWSCJMLAOKQ-UHFFFAOYSA-N- Molecular formula
- C11H7NO2S
- Average molar mass
- 217.25 g/mol
- Monoisotopic mass
- 217.01974964
Names & identifiers
- Preferred name
- 8H-Indeno[1,2-d]thiazole-5-carboxylic acid
- IUPAC
- 4H-indeno[1,2-d][1,3]thiazole-7-carboxylic acid
- English name
- 8H-Indeno[1,2-d]thiazole-5-carboxylic acid
- Molecular formula
- C11H7NO2S
- Molecular weight
- 217.24
Names & synonyms
8H-Indeno[1,2-d]thiazole-5-carboxylic acid1245648-00-34H-indeno[1,2-d][1,3]thiazole-7-carboxylic acid8H-Indeno[1,2-d]thiazole-5-carboxylicacid8H-INDENO[1,2-D][1,3]THIAZOLE-5-CARBOXYLIC ACIDDTXSID40855930MB14550DA-18969
Database identifiers
- CAS
1245648-00-3- PubChem CID
- 71464151
- DTXSID
DTXSID40855930
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…