2,5-Difluorobenzoic acid - CAS 2991-28-8

Catalog: BB020374
Product Name: 2,5-Difluorobenzoic acid
CAS: 2991-28-8
Synonyms: NSC 190310; 5-Difluorobenzoic acid; 2,5-difluorobenzoate
2,5-Difluorobenzoic acid
IUPAC Name:2,5-difluorobenzoic acid
Description:2,5-Difluorobenzoic Acid acts as a reagent in the synthesis of rutaecarpine and analogs used for the removal of caffeine from the body. Prepparation of quinolone carboxylic acids as cell-permeable inhibitors of protein tyrosine phosphatase (Erratum). Preparation, molecular docking, and bioactivity of α-ketoamides as cathepsin S inhibitors with potential applications against tumor invasion and angiogenesis. Also used as new passive water tracers for oil field applications.
Molecular Weight:158.10
Molecular Formula:C7H4F2O2
Canonical SMILES:C1=CC(=C(C=C1F)C(=O)O)F
InChI:InChI=1S/C7H4F2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChI Key:LBQMIAVIGLLBGW-UHFFFAOYSA-N
Boiling Point:244.7±20.0°C (Predicted)
Melting Point:127-130°C
Purity:≥95%
Density:1.349 g/cm3 (Predicted)
Solubility:Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance:White solid
Storage:Store at 2-8°C under inert atmosphere
MDL:MFCD00002410
LogP:1.66300

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