N-(6-bromo-1,3-benzodioxol-5-yl)-2,2-dichloroacetamide
Basic information
- Standard SMILES
O=C(Nc1cc2c(cc1Br)OCO2)C(Cl)Cl- InChIKey
XZYYTKMTCPCZOF-UHFFFAOYSA-N- Molecular formula
- C9H6BrCl2NO3
- Average molar mass
- 326.96 g/mol
- Monoisotopic mass
- 324.89081
Names & identifiers
- Preferred name
- N-(6-bromo-1,3-benzodioxol-5-yl)-2,2-dichloroacetamide
- IUPAC
- N-(6-bromo-1,3-benzodioxol-5-yl)-2,2-dichloroacetamide
Names & synonyms
NSC174075NSC-174075
Database identifiers
- PubChem CID
- 300019
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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