Basic information
- CAS
84604-84-2- Standard SMILES
O=[N+]([O-])c1ccc(Oc2cc(Br)c(Br)cc2O)cc1- InChIKey
SOCIRCCLOXVPNG-UHFFFAOYSA-N- Molecular formula
- C12H7Br2NO4
- Average molar mass
- 389 g/mol
- Monoisotopic mass
- 386.87418
Names & identifiers
- Preferred name
- 4,5-Dibromo-2-(4-nitrophenoxy)phenol
- IUPAC
- 4,5-dibromo-2-(4-nitrophenoxy)phenol
- English name
- 4,5-dibromo-2-(4-nitrophenoxy)phenol
- Molecular formula
- C12H7Br2NO4
- Molecular weight
- 388.99628
Names & synonyms
4,5-Dibromo-2-(4-nitrophenoxy)phenolEINECS 283-368-784604-84-2DTXSID10233600RefChem:96438DTXCID00156091283-368-7SOCIRCCLOXVPNG-UHFFFAOYSA-NNS00038578
Database identifiers
- CAS
84604-84-2- PubChem CID
- 3020003
- DTXSID
DTXSID10233600- EC Number
- 283-368-7
- Nikkaji
- J333.522D
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 317
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
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