4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid
- CAS No.
- 162046-66-4
- Chemical Name:
- 4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid
- Synonyms
- 4-(4-(TERT-BUTOXYCARBONYL)PIPERAZIN-1-YL)BENZOIC ACID;BUTTPARK 98\06-97;Boc-piperazine-benzoic acid;4-[N-Boc-piperazino]benzoic acid;4-(4-Boc-piperazin-1-yl)-benzoic a;4-(4-Boc-1-piperazinyl)benzoic Acid;4-(4-Boc-1-piperazineyl)benzoic acid;1-(4-carboxyphenyl)-4-Boc piperazine;1-BOC-4-(4-CARBOXY-PHENYL)-PIPERAZINE;1-(4-BOC-PIPERAZIN-1-YL)-BENZOIC ACID
- CBNumber:
- CB6714965
- Molecular Formula:
- C16H22N2O4
- Molecular Weight:
- 306.36
- MDL Number:
- MFCD04115067
- MOL File:
- 162046-66-4.mol
| Product description | Number | Pack Size | Price |
| 4-(4-carboxy-phenyl)-piperazine-1-carboxylic acid tert-butyl ester Aldrich | CDS007031 | 10mg | $73.1 |
| 4-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoicAcid | B809938 | 100mg | $75 |
| 1-(4-Boc-piperazin-1-yl)benzoic acid | FB50839 | 1g | $83.6 |
| 4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]benzoic acid 97% | 4H58-1-W0 | 1g | $88 |
| 4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]benzoic acid 97% | 4H58-1-W0 | 250mg | $24 |
| More product size | |||
| 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 |
| pka | 5.12±0.10(Predicted) |
| form | powder |
| 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) |
| UNSPSC Code | 12352108 |
| NACRES | NA.21 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) | ![]() GHS07 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H302-H315-H319 | |||||||||
| Precautionary statements | P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330 | |||||||||
| 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 | |||||||||
| NFPA 704 |
|
4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid price More Price(30)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | CDS007031 | 4-(4-carboxy-phenyl)-piperazine-1-carboxylic acid tert-butyl ester Aldrich | 162046-66-4 | 10mg | $73.1 | 2025-07-31 | Buy |
| TRC | B809938 | 4-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoicAcid | 162046-66-4 | 100mg | $75 | 2021-12-16 | Buy |
| Biosynth Carbosynth | FB50839 | 1-(4-Boc-piperazin-1-yl)benzoic acid | 162046-66-4 | 1g | $83.6 | 2021-12-16 | Buy |
| SynQuest Laboratories | 4H58-1-W0 | 4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]benzoic acid 97% | 162046-66-4 | 1g | $88 | 2021-12-16 | Buy |
| SynQuest Laboratories | 4H58-1-W0 | 4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]benzoic acid 97% | 162046-66-4 | 250mg | $24 | 2021-12-16 | Buy |
4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid Chemical Properties,Uses,Production
Uses
Boc-piperazine-benzoic acid is a PROTAC linker and can be used in the synthesis of PROTACs, such as PROTAC androgen receptor (AR) degrader ARD-2128 (HY-13229)[1].
Synthesis
158985-36-5
162046-66-4
General procedure for the synthesis of tert-butyl 4-(4-carboxyphenyl)piperazine-1-carboxylate from tert-butyl 4-(4-(methoxycarbonyl)phenyl)piperazine-1-carboxylate: 4-(4-(methoxycarbonyl)phenyl)piperazine-1-carboxylic acid tert-butyl ester (3.2 g, 10 mmol) was reacted with 2M NaOH solution (50 mL) in a mixture of THF (50 mL) and EtOH ( 50 mL) in a mixed solvent and the reaction was stirred at 60 °C for 3 hours. After completion of the reaction, the reaction mixture was concentrated to give a residue. The pH of the residue was adjusted to 7 with 2M HCl solution and filtered to afford tert-butyl 4-(4-carboxyphenyl)piperazine-1-carboxylate as a white solid (3.0 g, 100% yield).
References
[1] Han X, et al. Strategies toward Discovery of Potent and Orally Bioavailable Proteolysis Targeting Chimera Degraders of Androgen Receptor for the Treatment of Prostate Cancer. J Med Chem. 2021;64(17):12831-12854.
4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid Preparation Products And Raw materials
Raw materials
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Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Capot Chemical Co.,Ltd. | +86-(0)57185586718; +8613336195806 | sales@capot.com | China | 29735 | 60 |
| ATK CHEMICAL COMPANY LIMITED | +undefined-21-51877795 | ivan@atkchemical.com | China | 33024 | 60 |
| career henan chemical co | +86-0371-86658258 +8613203830695 | sales@coreychem.com | China | 29831 | 58 |
| Accela ChemBio Inc. | +1-858-6993322 | info@accelachem.com | United States | 21193 | 58 |
| Alchem Pharmtech,Inc. | 8485655694 | sales@alchempharmtech.com | United States | 63687 | 58 |
| Wuhan Chemwish Technology Co., Ltd | 027-67849912 | sales@chemwish.com | CHINA | 10821 | 58 |
| CONIER CHEM AND PHARMA LIMITED | +8618523575427 | sales@conier.com | China | 49977 | 58 |
| Hubei Ipure Biology Co., Ltd | +8613367258412 | ada@ipurechemical.com | China | 10236 | 58 |
| HONG KONG IPURE BIOLOGY CO.,LIMITED | 86 18062405514 18062405514 | ada@ipurechemical.com | CHINA | 3461 | 58 |
| Dayang Chem (Hangzhou) Co.,Ltd. | +86-0571-88938639 +8617705817739 | info@dycnchem.com | China | 52846 | 58 |
View Lastest Price from 4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid manufacturers
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2019-09-05 | 4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid
162046-66-4
|
US $5.00 / KG | 1KG | 95%-98% | 100kg | Career Henan Chemical Co |
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![4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid pictures](https://img.chemicalbook.com/ProductImageEN/2019-9/Small/a3b41bbb-04ff-4d23-9729-bffcc76b8420.png)
- 4-[4-(tert-Butoxycarbonyl)piperazino]benzoic acid
162046-66-4
- US $5.00 / KG
- 95%-98%
- Career Henan Chemical Co
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