Basic information
- CAS
84604-86-4- Standard SMILES
COc1cc(Br)c(Br)cc1Oc1ccc([N+](=O)[O-])cc1- InChIKey
RJPFFSWADWMPCT-UHFFFAOYSA-N- Molecular formula
- C13H9Br2NO4
- Average molar mass
- 403.02 g/mol
- Monoisotopic mass
- 400.88983
Names & identifiers
- Preferred name
- 4,5-Dibromo-2-(4-nitrophenoxy)anisole
- IUPAC
- 1,2-dibromo-4-methoxy-5-(4-nitrophenoxy)benzene
- English name
- 4,5-dibromo-2-(4-nitrophenoxy)anisole
- Molecular formula
- C13H9Br2NO4
- Molecular weight
- 403.02286
Names & synonyms
4,5-Dibromo-2-(4-nitrophenoxy)anisole84604-86-4EINECS 283-370-81,2-dibromo-4-methoxy-5-(4-nitrophenoxy)benzeneDTXSID30233602RJPFFSWADWMPCT-UHFFFAOYSA-NNS00038580Benzene,1,2-dibromo-4-methoxy-5-(4-nitrophenoxy)-
Database identifiers
- CAS
84604-86-4- PubChem CID
- 3020005
- DTXSID
DTXSID30233602- EC Number
- 283-370-8
- Nikkaji
- J333.524K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 331
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…