Basic information
- CAS
58956-81-3- Standard SMILES
O=C(NC(O)C(Cl)Cl)c1ccc(Cl)cc1- InChIKey
MIPFLOQARPRKRZ-UHFFFAOYSA-N- Molecular formula
- C9H8Cl3NO2
- Average molar mass
- 268.5 g/mol
- Monoisotopic mass
- 266.962062
Names & identifiers
- Preferred name
- ST50980950
- IUPAC
- 4-chloro-N-(2,2-dichloro-1-hydroxyethyl)benzamide
Names & synonyms
58956-81-3ST50980950DTXSID10404772RefChem:381723DTXCID803556264-chloro-N-(2,2-dichloro-1-hydroxyethyl)benzamideAKOS003624227N-(2,2-dichloro-1-hydroxyethyl)(4-chlorophenyl)carboxamide
Database identifiers
- CAS
58956-81-3- PubChem CID
- 4603772
- DTXSID
DTXSID10404772
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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