3-Chloro-4-fluoro-6-nitro-1H-indazole
Basic information
- CAS
885520-10-5- Standard SMILES
O=[N+]([O-])c1cc(F)c2c(Cl)n[nH]c2c1- InChIKey
HETKCEGRFLRGPE-UHFFFAOYSA-N- Molecular formula
- C7H3ClFN3O2
- Average molar mass
- 215.57 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-4-fluoro-6-nitro-1H-indazole
- IUPAC
- 3-chloro-4-fluoro-6-nitro-2H-indazole
- English name
- 3-Chloro-4-fluoro-6-nitro (1H)indazole
- Molecular formula
- C7H3ClFN3O2
- Molecular weight
- 215.57
Names & synonyms
3-Chloro-4-fluoro-6-nitro-1H-indazole885520-10-53-Chloro-4-fluoro-6-nitro (1H)indazole3-chloro-4-fluoro-6-nitro-2H-indazolePB30975CS-0055397P105141H-Indazole, 3-chloro-4-fluoro-6-nitro-
Database identifiers
- CAS
885520-10-5
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 250
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Compound notes
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