2-Aminoethyl 2,6-Dimethyl-5-Nitro-4-[2-(Trifluoromethyl)Phenyl]-1,4-Dihydro-3-Pyridinecarboxylate
[CAS# 129238-72-8]

Identification

• Name: 2-Aminoethyl 2,6-Dimethyl-5-Nitro-4-[2-(Trifluoromethyl)Phenyl]-1,4-Dihydro-3-Pyridinecarboxylate
• Synonyms: 1,4-Dihydro-2,6-dimethyl-3-nitro-4-(2-trifluoromethylphenyl)pyridine-5-carboxy-2-aminoethyl ester; Bay W 5035; Bay W-5035
• Molecular Formula: C₁₇H₁₈F₃N₃O₄
• Molecular Weight: 385.34
• CAS Registry Number: 129238-72-8
• SMILES: O=[N+]([O-])\C1=C(\N/C(=C(/C(=O)OCCN)C1c2ccccc2C(F)(F)F)C)C
• InChI: 1S/C17H18F3N3O4/c1-9-13(16(24)27-8-7-21)14(15(23(25)26)10(2)22-9)11-5-3-4-6-12(11)17(18,19)20/h3-6,14,22H,7-8,21H2,1-2H3
• InChIKey: RCJFYGYHESLEHK-UHFFFAOYSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 489.56°C at 760 mmHg (Cal.)
• Flash point: 249.877°C (Cal.)
• Refractive index: 1.558 (Cal.)