98% , 106268-96-6

CAS NO.：106268-96-6

Empirical Formula: C11H11NO5

Molecular Weight: 237.21

MDL number: MFCD00012315

PRODUCT Properties

• Melting point: 87-89 °C(lit.)
• Boiling point: 379.74°C (rough estimate)
• Density: 1.3350 (rough estimate)
• refractive index: 1.5300 (estimate)
• storage temp.: 2-8°C
• solubility: soluble in Chloroform, DCM
• form: Solid
• color: Light Yellow
• optical activity: [α]19/D 5.9°, c = 2.4 in chloroform
• InChI: InChI=1S/C11H12NO6/c1-11(5-13,6-18-11)9-4-7(12(16)17)2-3-8(9)10(14)15/h2-4,13H,5-6H2,1H3,(H,14,15)
• InChIKey: KBYNTFSZTDWVEU-UHFFFAOYSA-N
• SMILES: O1CC1(C)(C1=CC([N+]([O-])=O)=CC=C1C(O)=O)CO

Description and Uses

(R)-(-)-2-Methylglycidyl 4-Nitrobenzoate is an intermediate in the synthesis of Delamanid (D230660), a novel anti-tuberculosis medication that inhibits mycolic acid synthesis and shows potent in-vitro and in-vivo activity against drug-resistant strains of Mycobacterium tuberculosis.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P305+P351+P338
• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 26-37/39
• WGK Germany: 3
• RTECS: RR0510300