2-Methyl-4-nitrobenzoic acid , 97% , 1975-51-5

CAS NO.：1975-51-5

Empirical Formula: C8H7NO4

Molecular Weight: 181.15

MDL number: MFCD00210697

EINECS: 217-828-5

PRODUCT Properties

• Melting point: 150-154 °C (lit.)
• Boiling point: 153 °C
• Density: 1.392±0.06 g/cm3(Predicted)
• storage temp.: Sealed in dry,Room Temperature
• solubility: DMSO (Slightly), Methanol (Slightly)
• form: Solid
• pka: pK1:1.86 (25°C)
• color: Pale Yellow to Yellow
• InChI: InChI=1S/C8H7NO4/c1-5-4-6(9(12)13)2-3-7(5)8(10)11/h2-4H,1H3,(H,10,11)
• InChIKey: XXXOBNJIIZQSPT-UHFFFAOYSA-N
• SMILES: C(O)(=O)C1=CC=C([N+]([O-])=O)C=C1C

Description and Uses

2-Methyl-4-nitrobenzoic acid is used as a reagent to synthesize amino-1H-pyrazole amide derivatives, compounds that act as Raf kinase inhibitors in melanoma cells. 2-Methyl-4-nitrobenzoic acid is also used as a reagent to synthesize fluorogenic substrates, compounds that can be used for activity imaging within living cells.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H317
• Precautionary statements: P280-P301+P312+P330-P302+P352
• Hazard Codes: Xn
• Risk Statements: 22-43
• Safety Statements: 37/39
• WGK Germany: 3
• HS Code: 29163100