7-Nitroindole , 99% , 6960-42-5

Synonym(s):
NSC 69874

CAS NO.：6960-42-5

Empirical Formula: C8H6N2O2

Molecular Weight: 162.15

MDL number: MFCD00005683

EINECS: 677-504-8

PRODUCT Properties

• Melting point: 94-98 °C (lit.)
• Boiling point: 288.82°C (rough estimate)
• Density: 1.3264 (rough estimate)
• refractive index: 1.5770 (estimate)
• storage temp.: Sealed in dry,Room Temperature
• form: powder to crystal
• pka: 13.96±0.30(Predicted)
• color: Light yellow to Yellow to Orange
• Water Solubility: slightly soluble
• BRN: 130874
• InChI: InChI=1S/C8H6N2O2/c11-10(12)7-3-1-2-6-4-5-9-8(6)7/h1-5,9H
• InChIKey: LZJGQIVWUKFTRD-UHFFFAOYSA-N
• SMILES: N1C2=C(C=CC=C2[N+]([O-])=O)C=C1
• CAS DataBase Reference: 6960-42-5(CAS DataBase Reference)

Description and Uses

Reactant for preparation of:

• Protein kinase inhibitors
• Potential fructose 1,6-bisphosphatase inhibitors
• Factor Xa inhibitors
• Antagonist of the mineralocorticoid receptor
• Antitumor sulfonamides
• Inosine monophosphate dehydrogenase (IMPDH) inhibitors
• Subtype-selective cyclooxygenase (COX) inhibitors
• Thrombin protease-activated receptor (PAR-1) ligands

Safety

• Symbol(GHS): GHS08
• Signal word: Warning
• Hazard statements: H341
• Precautionary statements: P201-P202-P280-P308+P313-P405-P501a
• Hazard Codes: Xn,Xi
• Risk Statements: 68
• Safety Statements: 36/37-45
• WGK Germany: 3
• RTECS: NM1169000
• Hazard Note: Irritant
• HazardClass: IRRITANT-HARMFUL
• HS Code: 29339900