Basic information
- CAS
4072-48-4- Standard SMILES
O=[N+]([O-])c1ccc([I+]c2ccccc2)cc1.[Br-]- InChIKey
KWVVQCUQKOQNKK-UHFFFAOYSA-M- Molecular formula
- C12H9BrINO2
- Average molar mass
- 406.01 g/mol
- Monoisotopic mass
- 404.88614
Overview
structure in first source
Names & identifiers
- Preferred name
- 2-Nitrophenylphenyliodonium
- IUPAC
- (4-nitrophenyl)-phenyliodanium bromide
- English name
- 2-nitrophenylphenyliodonium
- Molecular weight
- 0
Names & synonyms
2-Nitrophenylphenyliodonium4072-48-4RefChem:88747(p-Nitrophenyl)phenyliodonium bromideIodonium, (4-nitrophenyl)phenyl-, bromideNSC-86354IODONIUM, (p-NITROPHENYL)PHENYL-, BROMIDENSC86354NSC 86354AS654NFV9NCHEMBL1980597DTXSID80961145
Show more names
2-Nitrophenylphenyliodonium bromideO-nitrophenylphenyliodonium fluoride(4-Nitrophenyl)phenyliodonium bromide(4-Nitrophenyl)(phenyl)iodanium bromideWLN: WNR D-I-R &E &7/12
Database identifiers
- CAS
4072-48-4- PubChem CID
- 19992
- DTXSID
DTXSID80961145- ChEMBL
CHEMBL1980597- UNII
- AS654NFV9N
Properties
Computed structural properties
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 228
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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