1-(4-chlorobutanoyl)-5-nitro-1H-indazole
Basic information
- CAS
127245-99-2- Standard SMILES
O=C(CCCCl)n1ncc2cc([N+](=O)[O-])ccc21- InChIKey
OFKCGPJHQNWYMX-UHFFFAOYSA-N- Molecular formula
- C11H10ClN3O3
- Average molar mass
- 267.67 g/mol
Names & identifiers
- Preferred name
- 1-(4-chlorobutanoyl)-5-nitro-1H-indazole
- IUPAC
- 4-chloro-1-(5-nitroindazol-1-yl)butan-1-one
- English name
- 1-(4-Chlorobutanoyl)-5-nitro-1H-indazole
- Molecular formula
- C11H10ClN3O3
- Molecular weight
- 267.67
Names & synonyms
1-(4-chlorobutanoyl)-5-nitro-1H-indazole127245-99-24-chloro-1-(5-nitro-1H-indazol-1-yl)butan-1-one4-chloro-1-(5-nitroindazol-1-yl)butan-1-oneAG-777/36179048
Database identifiers
- CAS
127245-99-2
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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