Methyl 5,7-dibromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Basic information
- CAS
70964-52-2- Standard SMILES
COC(=O)n1c(=O)oc2c(Br)cc(Br)cc21- InChIKey
DPTPYWSMAZNLIJ-UHFFFAOYSA-N- Molecular formula
- C9H5Br2NO4
- Average molar mass
- 350.95 g/mol
- Monoisotopic mass
- 348.85853
Names & identifiers
- Preferred name
- Methyl 5,7-dibromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
- IUPAC
- methyl 5,7-dibromo-2-oxo-1,3-benzoxazole-3-carboxylate
Names & synonyms
70964-52-2NSC355371DTXSID80320137Methyl 5,7-dibromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylateNSC-355371
Database identifiers
- CAS
70964-52-2- PubChem CID
- 337437
- DTXSID
DTXSID80320137
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…