Basic information
- CAS
1167056-40-7- Standard SMILES
O=[N+]([O-])c1cc(I)cc2cn[nH]c12- InChIKey
NXDZVOSGNJYFLG-UHFFFAOYSA-N- Molecular formula
- C7H4IN3O2
- Average molar mass
- 289.03 g/mol
- Monoisotopic mass
- 288.93482
Names & identifiers
- Preferred name
- 5-iodo-7-nitro-1H-indazole
- IUPAC
- 5-iodo-7-nitro-1H-indazole
Names & synonyms
5-iodo-7-nitro-1H-indazole1167056-40-71H-Indazole, 5-iodo-7-nitro-DTXSID801310985
Database identifiers
- CAS
1167056-40-7- PubChem CID
- 53399643
- DTXSID
DTXSID801310985
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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