methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate
[CAS# 952665-00-8]

Identification

• Name: methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate
• Synonyms: methyl 2-tert-butyl-5-nitro-1H-indole-7-carboxylate
• Molecular Formula: C₁₄H₁₆N₂O₄
• Molecular Weight: 276.29
• CAS Registry Number: 952665-00-8
• SMILES: CC(C)(C)c1cc2cc(cc(c2[nH]1)C(=O)OC)[N+](=O)[O-]
• InChI: 1S/C14H16N2O4/c1-14(2,3)11-6-8-5-9(16(18)19)7-10(12(8)15-11)13(17)20-4/h5-7,15H,1-4H3
• InChIKey: CAMMTUHPGSXTMO-UHFFFAOYSA-N

Properties

• Density: 1.266g/cm³ (Cal.)
• Boiling point: 443.117°C at 760 mmHg (Cal.)
• Flash point: 221.789°C (Cal.)
• Refractive index: 1.606 (Cal.)