Basic information
- CAS
16328-30-6- Standard SMILES
C=CC(=O)NC(O)C(Cl)(Cl)Cl- InChIKey
WJGQBTHAJQOPOM-UHFFFAOYSA-N- Molecular formula
- C5H6Cl3NO2
- Average molar mass
- 218.46 g/mol
- Monoisotopic mass
- 216.946412
Names & identifiers
- Preferred name
- n-(2,2,2-Trichloro-1-hydroxyethyl)prop-2-enamide
- IUPAC
- N-(2,2,2-trichloro-1-hydroxyethyl)prop-2-enamide
Names & synonyms
n-(2,2,2-trichloro-1-hydroxyethyl)prop-2-enamide16328-30-6NSC52796SCHEMBL1070089DTXSID40281654NSC22403NSC-22403NSC-52796AKOS003619222EN300-6890137
Database identifiers
- CAS
16328-30-6- PubChem CID
- 229042
- DTXSID
DTXSID40281654- Nikkaji
- J441.061K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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