1-(2-chloro-1H-imidazol-5-yl)ethanone
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Basic information
- CAS
889942-27-2- Standard SMILES
CC(=O)c1cnc(Cl)[nH]1- InChIKey
QJSJFRUXSDFTIC-UHFFFAOYSA-N- Molecular formula
- C5H5ClN2O
- Average molar mass
- 144.56 g/mol
- Monoisotopic mass
- 144.0090405
Names & identifiers
- Preferred name
- 1-(2-chloro-1H-imidazol-5-yl)ethanone
- IUPAC
- 1-(2-chloro-1H-imidazol-5-yl)ethanone
- English name
- Ethanone, 1-(2-chloro-1H-imidazol-5-yl)-
- Molecular formula
- C5H5ClN2O
- Molecular weight
- 0
Names & synonyms
Ethanone, 1-(2-chloro-1H-imidazol-5-yl)-
Database identifiers
- CAS
889942-27-2- PubChem CID
- 25417106
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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