(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)(1-naphthyl)acetic acid
[CAS# 885274-72-6]

Identification

• Name: (4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)(1-naphthyl)acetic acid
• Synonyms: 2-(4-Boc-piperazinyl)-2-(1-naphthalenyl)acetic acid; 4-(carboxy-naphthalen-1-yl-methyl)-piperazine-1-carboxylicacidtert-butylesterhydrochloride
• Molecular Formula: C₂₁H₂₆N₂O₄
• Molecular Weight: 370.44
• CAS Registry Number: 885274-72-6
• SMILES: O=C(O)C(c2c1ccccc1ccc2)N3CCN(C(=O)OC(C)(C)C)CC3
• InChI: 1S/C21H26N2O4/c1-21(2,3)27-20(26)23-13-11-22(12-14-23)18(19(24)25)17-10-6-8-15-7-4-5-9-16(15)17/h4-10,18H,11-14H2,1-3H3,(H,24,25)
• InChIKey: DDVSCUBGOYVIJP-UHFFFAOYSA-N

Properties

• Density: 1.235g/cm³ (Cal.)
• Boiling point: 516.043°C at 760 mmHg (Cal.)
• Flash point: 265.894°C (Cal.)
• Refractive index: 1.607 (Cal.)