Basic information
- Standard SMILES
CC(=O)c1nn(CC(=O)OC(C)(C)C)c2ccccc12- InChIKey
GFPAHKINDNKONS-UHFFFAOYSA-N- Molecular formula
- C15H18N2O3
- Average molar mass
- 274.31 g/mol
- Monoisotopic mass
- 274.13174244
Names & identifiers
- Preferred name
- tert-butyl 2-(3-acetyl-1H-indazol-1-yl)acetate
- IUPAC
- tert-butyl 2-(3-acetylindazol-1-yl)acetate
Names & synonyms
tert-butyl 2-(3-acetyl-1H-indazol-1-yl)acetate1386457-48-2SCHEMBL12480155GFPAHKINDNKONS-UHFFFAOYSA-NDA-45426
Database identifiers
- PubChem CID
- 68283733
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 61.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 389
Related reactions
3 records
Compound notes
Loading…