3-Bromo-5-nitrobenzotrifluoride , ≥97.0% , 630125-49-4

CAS NO.：630125-49-4

Empirical Formula: C7H3BrF3NO2

Molecular Weight: 270

MDL number: MFCD03788719

PRODUCT Properties

• Boiling point: 223.7±35.0 °C(Predicted)
• Density: 1.788±0.06 g/cm3(Predicted)
• refractive index: 1.515
• storage temp.: Sealed in dry,Room Temperature
• solubility: Chloroform (Slightly), Methanol (Slightly)
• form: Oil
• color: Colourless
• InChI: InChI=1S/C7H3BrF3NO2/c8-5-1-4(7(9,10)11)2-6(3-5)12(13)14/h1-3H
• InChIKey: YHTVYRKVFAFVLP-UHFFFAOYSA-N
• SMILES: C1(Br)=CC(C(F)(F)F)=CC([N+]([O-])=O)=C1
• CAS DataBase Reference: 630125-49-4(CAS DataBase Reference)

Description and Uses

3-Bromo-5-nitrobenzotrifluoride is an important organic synthetic compound and a pharmaceutical intermediate component. It can be used in the preparation of SOS1 degraders and nilotinib hydrochloride.

3-Bromo-5-nitrobenzotrifluoride is an efficient D-glucosamine-based copper catalyst for C-X couplings and its application in synthesis of nilotinib intermediate. 3-Bromo-5-nitrobenzotrifluoride is also an intermediate for Nilotinib (N465300).

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H312-H315-H319-H332
• Precautionary statements: P280h-P305+P351+P338-P337+P313
• Hazard Codes: Xi
• Risk Statements: 20/21/22-36/37/38-36/38
• Safety Statements: 26-36/37/39-36/37
• HazardClass: IRRITANT
• HS Code: 29049090