2-Bromo-1-(4-bromo-2,6-dimethoxyphenoxy)-3,4,5-trimethoxybenzene
Basic information
- CAS
58235-54-4- Standard SMILES
COc1cc(Br)cc(OC)c1Oc1cc(OC)c(OC)c(OC)c1Br- InChIKey
RSAPJZJRTJIRKS-UHFFFAOYSA-N- Molecular formula
- C17H18Br2O6
- Average molar mass
- 478.1 g/mol
- Monoisotopic mass
- 475.94701
Names & identifiers
- Preferred name
- 2-Bromo-1-(4-bromo-2,6-dimethoxyphenoxy)-3,4,5-trimethoxybenzene
- IUPAC
- 2-bromo-1-(4-bromo-2,6-dimethoxyphenoxy)-3,4,5-trimethoxybenzene
Names & synonyms
58235-54-4NSC2375062-bromo-1-(4-bromo-2,6-dimethoxyphenoxy)-3,4,5-trimethoxybenzeneDTXSID90311016NSC-237506
Database identifiers
- CAS
58235-54-4- PubChem CID
- 314905
- DTXSID
DTXSID90311016
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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