Basic information
- Standard SMILES
CC(=O)c1nc(CCl)cs1- InChIKey
KVIZDZZLHUOYJF-UHFFFAOYSA-N- Molecular formula
- C6H6ClNOS
- Average molar mass
- 175.64 g/mol
Names & identifiers
- Preferred name
- 1-(4-Chloromethyl-thiazol-2-yl)ethanone
- IUPAC
- 1-[4-(chloromethyl)-1,3-thiazol-2-yl]ethanone
Names & synonyms
1-(4-Chloromethyl-thiazol-2-yl)ethanone1161775-52-5SCHEMBL855213KVIZDZZLHUOYJF-UHFFFAOYSA-N1-(4-chloromethyl-thiazol-2-yl)-ethanoneDB-353984
Database identifiers
- PubChem CID
- 66819977
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 142
Related reactions
10 records
Compound notes
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