Basic information
- Standard SMILES
Nc1ccc2c(c1Br)OCO2- InChIKey
CUDINBZXGYKTAY-UHFFFAOYSA-N- Molecular formula
- C7H6BrNO2
- Average molar mass
- 216.03 g/mol
Names & identifiers
- Preferred name
- 2-Bromo-3,4-(methylenedioxy)aniline
- IUPAC
- 4-bromo-1,3-benzodioxol-5-amine
Names & synonyms
SCHEMBL14720885CUDINBZXGYKTAY-UHFFFAOYSA-N2-bromo-3,4-(methylenedioxy)aniline
Database identifiers
- PubChem CID
- 89415048
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Related reactions
1 records
Compound notes
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