4-(2-Carboxybenzoyl)-1-Piperazinecarboxylicacid 1-(1,1-Dimethylethyl) Ester
[CAS# 651293-35-5]

Identification

• Name: 4-(2-Carboxybenzoyl)-1-Piperazinecarboxylicacid 1-(1,1-Dimethylethyl) Ester
• Synonyms: 2-(4-Tert-Butoxycarbonylpiperazine-1-Carbonyl)Benzoic Acid; 2-[[4-(Tert-Butoxy-Oxomethyl)-1-Piperazinyl]-Oxomethyl]Benzoic Acid; 2-[4-[(2-Methylpropan-2-Yl)Oxycarbonyl]Piperazin-1-Yl]Carbonylbenzoic Acid
• Molecular Formula: C₁₇H₂₂N₂O₅
• Molecular Weight: 334.37
• CAS Registry Number: 651293-35-5
• SMILES: C1=CC=CC(=C1C(N2CCN(C(OC(C)(C)C)=O)CC2)=O)C(=O)O
• InChI: 1S/C17H22N2O5/c1-17(2,3)24-16(23)19-10-8-18(9-11-19)14(20)12-6-4-5-7-13(12)15(21)22/h4-7H,8-11H2,1-3H3,(H,21,22)
• InChIKey: BJIBSCUTCOZJGB-UHFFFAOYSA-N

Properties

• Density: 1.26g/cm³ (Cal.)
• Boiling point: 519.246°C at 760 mmHg (Cal.)
• Flash point: 267.831°C (Cal.)