2,2,2-Trichloro-1-oxiranyl-ethanone
Basic information
- CAS
60565-60-8- Standard SMILES
O=C(C1CO1)C(Cl)(Cl)Cl- InChIKey
VJGAWNOGMVQBMS-UHFFFAOYSA-N- Molecular formula
- C4H3Cl3O2
- Average molar mass
- 189.42 g/mol
- Monoisotopic mass
- 187.919862
Names & identifiers
- Preferred name
- 2,2,2-Trichloro-1-oxiranyl-ethanone
- IUPAC
- 2,2,2-trichloro-1-(oxiran-2-yl)ethanone
- English name
- Ethanone, 2,2,2-trichloro-1-oxiranyl- (9CI)
- Molecular formula
- C4H3Cl3O2
- Molecular weight
- 189.42
Names & synonyms
60565-60-82,2,2-TRICHLORO-1-OXIRANYL-ETHANONENSC294654SCHEMBL11727953DTXSID40315448Ethanone,2,2-trichloro-1-oxiranyl-NSC-294654Ethanone, 2,2,2-trichloro-1-oxiranyl-DB-3263042,2,2-Trichloro-1-(oxiran-2-yl)ethan-1-oneEthanone, 2,2,2-trichloro-1-(2-oxiranyl)-Ethanone, 2,2,2-trichloro-1-oxiranyl- (9CI)
Database identifiers
- CAS
60565-60-8- PubChem CID
- 325628
- DTXSID
DTXSID40315448
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 29.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 139
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Compound notes
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