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4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid Structure

4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid

Chemical Properties

Melting point 50 °C
Boiling point 476.9±40.0 °C(Predicted)
Density  1.213±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
form  powder
pka 5.12±0.10(Predicted)
color  Off-white
InChI 1S/C16H22N2O4/c1-16(2,3)22-15(21)18-10-8-17(9-11-18)13-6-4-12(5-7-13)14(19)20/h4-7H,8-11H2,1-3H3,(H,19,20)
InChIKey BEDWYXZFIYMEJG-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(cc2)C(O)=O
CAS DataBase Reference 162046-66-4(CAS DataBase Reference)

Safety Information

Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  22-26-36/37/39
Hazard Note  Harmful
HS Code  2933599590
Storage Class 11 - Combustible Solids

Usage And Synthesis

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