(3-Methylphenyl)(4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)acetic acid
[CAS# 885274-08-8]

Identification

• Name: (3-Methylphenyl)(4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)acetic acid
• Synonyms: 2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(m-tolyl)acetic acid; 2-(4-Boc-piperazinyl)-2-(3-methylphenyl)acetic acid; 2-(4-Boc-piperazinyl)-2-(3-methyl-phenyl)acetic acid
• Molecular Formula: C₁₈H₂₆N₂O₄
• Molecular Weight: 334.41
• CAS Registry Number: 885274-08-8
• SMILES: O=C(O)C(c1cccc(c1)C)N2CCN(C(=O)OC(C)(C)C)CC2
• InChI: 1S/C18H26N2O4/c1-13-6-5-7-14(12-13)15(16(21)22)19-8-10-20(11-9-19)17(23)24-18(2,3)4/h5-7,12,15H,8-11H2,1-4H3,(H,21,22)
• InChIKey: BNJJGALLZCKLBR-UHFFFAOYSA-N

Properties

• Density: 1.185g/cm³ (Cal.)
• Boiling point: 449.998°C at 760 mmHg (Cal.)
• Flash point: 225.951°C (Cal.)
• Refractive index: 1.555 (Cal.)