Basic information
- CAS
76919-45-4- Standard SMILES
CC(=O)OCc1c(Cl)nc2sccn12- InChIKey
QCTBEEWTVLGBKC-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2O2S
- Average molar mass
- 230.67 g/mol
- Monoisotopic mass
- 229.9916763
Names & identifiers
- Preferred name
- (6-Chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl acetate
- IUPAC
- (6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl acetate
Names & synonyms
76919-45-4(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl acetateNSC332697DTXSID40318555NSC-332697DS-001613IMIDAZO[2,1-B]THIAZOLE-5-METHANOL,6-CHLORO-, 5-ACETATE
Database identifiers
- CAS
76919-45-4- PubChem CID
- 332995
- DTXSID
DTXSID40318555
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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