Basic information
- Standard SMILES
COC(=O)n1nc(C(C)=O)c2ccccc21- InChIKey
ALEGLBMCJQUJJK-UHFFFAOYSA-N- Molecular formula
- C11H10N2O3
- Average molar mass
- 218.21 g/mol
- Monoisotopic mass
- 218.06914219
Names & identifiers
- Preferred name
- methyl 3-acetyl-1H-indazole-1-carboxylate
- IUPAC
- methyl 3-acetylindazole-1-carboxylate
Names & synonyms
methyl 3-acetyl-1H-indazole-1-carboxylateSCHEMBL12525871ALEGLBMCJQUJJK-UHFFFAOYSA-NDB-1720361399850-94-2
Database identifiers
- PubChem CID
- 68309961
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 306
Related reactions
1 records
Compound notes
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