Basic information
- Standard SMILES
COc1c([N+](=O)[O-])ccc(C(=O)O)c1Br- InChIKey
SORVSIOJWHKPIV-UHFFFAOYSA-N- Molecular formula
- C8H6BrNO5
- Average molar mass
- 276.04 g/mol
Names & identifiers
- Preferred name
- 2-Bromo-3-methoxy-4-nitrobenzoic acid
- IUPAC
- 2-bromo-3-methoxy-4-nitrobenzoic acid
Names & synonyms
SCHEMBL15210381SORVSIOJWHKPIV-UHFFFAOYSA-N2-bromo-3-methoxy-4-nitrobenzoic acid
Database identifiers
- PubChem CID
- 89766930
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Related reactions
1 records
Compound notes
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