Basic information
- CAS
875577-67-6- Standard SMILES
O=C(O)c1nn(Cc2ccc(F)cc2F)c2ccccc12- InChIKey
ITZKRYFUROMVQS-UHFFFAOYSA-N- Molecular formula
- C15H10F2N2O2
- Average molar mass
- 288.25 g/mol
- Monoisotopic mass
- 288.07103389
Names & identifiers
- Preferred name
- 1H-Indazole-3-carboxylic acid, 1-[(2,4-difluorophenyl)methyl]-
- IUPAC
- 1-[(2,4-difluorophenyl)methyl]indazole-3-carboxylic acid
Names & synonyms
875577-67-61H-Indazole-3-carboxylic acid, 1-[(2,4-difluorophenyl)methyl]-SCHEMBL14595171SCHEMBL30949042DTXSID30469742AKOS0124074551-[(2,4-Difluorophenyl)methyl]-1H-indazole-3-carboxylic acid
Database identifiers
- CAS
875577-67-6- PubChem CID
- 11630634
- DTXSID
DTXSID30469742
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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