Methyl 4-amino-3,5-dibromo-2-hydroxybenzoate
Basic information
- CAS
6970-45-2- Standard SMILES
COC(=O)c1cc(Br)c(N)c(Br)c1O- InChIKey
BMADYDCSAWWAFM-UHFFFAOYSA-N- Molecular formula
- C8H7Br2NO3
- Average molar mass
- 324.95 g/mol
- Monoisotopic mass
- 322.87927
Names & identifiers
- Preferred name
- Methyl 4-amino-3,5-dibromo-2-hydroxybenzoate
- IUPAC
- methyl 4-amino-3,5-dibromo-2-hydroxybenzoate
Names & synonyms
6970-45-2methyl 4-amino-3,5-dibromo-2-hydroxybenzoateNSC61664DTXSID00289499NSC-61664
Database identifiers
- CAS
6970-45-2- PubChem CID
- 247268
- DTXSID
DTXSID00289499
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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