1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE

Base Information

• Chemical Name: 1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE
• CAS No.: 614730-97-1
• Molecular Formula: C11H20FNO3
• Molecular Weight: 233.283
• Hs Code.: 2933399090
• Mol file: 614730-97-1.mol

Synonyms:4-Fluoro-4-(hydroxymethyl)piperidine-1-carboxylicacid tert-butyl ester;tert-Butyl4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate;

Chemical Property of 1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.481
• Boiling Point: 311.017 °C at 760 mmHg
• PKA: 14.94±0.10(Predicted)
• Flash Point: 141.898 °C
• PSA: 49.77000
• Density: 1.137 g/cm³
• LogP: 1.65580
• Storage Temp.: 2-8°C

Purity/Quality:

98% ^*data from raw suppliers

tert-Butyl4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: tert-Butyl 4-Fluoro-4-(hydroxymethyl)piperidine-1-carboxylate is used in preparation of heterocyclic compounds as BCL 2 inhibitors.

Technology Process of 1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE

There total 5 articles about 1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

1-[(tert-butoxy)carbonyl]-4-fluoropiperidine-4-carboxylic acid (614731-04-3) → 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylic acid tert-butyl ester (614730-97-1)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 0 - 20 ℃; for 5h;

Reference yield: 88.1%

di-tert-butyl dicarbonate (24424-99-5) + [4-(trifluoromethyl)piperidin-4-yl]methanol hydrochloride → 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylic acid tert-butyl ester (614730-97-1)

Guidance literature:

With triethylamine; In methanol; at 20 ℃;

Reference yield: 69.0%

4-fluoropiperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester (416852-82-9) → 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylic acid tert-butyl ester (614730-97-1)

Guidance literature:

4-fluoropiperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester; With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃; for 0.166667h;

With sodium hydroxide; water; In tetrahydrofuran; diethyl ether; at 20 ℃;

upstream raw materials:

1-oxa-6-aza-spiro-[2.5]octane-6-caboxylic acid tert-butyl ester

4-fluoropiperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester

1-[(tert-butoxy)carbonyl]-4-fluoropiperidine-4-carboxylic acid

1-tert-butyl 4-ethyl piperidine-1,4-dicarboxylate

Refernces

• 1、 Zhou, Yu,Fu, Yan,Yin, Wanchao,Li, Jian,Wang, Wei,Bai, Fang,Xu, Shengtao,Gong, Qi,Peng, Tao,Hong, Yu,Zhang, Dong,Zhang, Dan,Liu, Qiufeng,Xu, Yechun,Xu, H. Eric,Zhang, Haiyan,Jiang, Hualiang,Liu, Hong. "Kinetics-Driven Drug Design Strategy for Next-Generation Acetylcholinesterase Inhibitors to Clinical Candidate". . p. 1844 - 1855. Retrieved 2021/03/01.
• 2、 Li, Junyou,Liu, Mengqi,Li, Yazhou,Sun, Dan-Dan,Shu, Zhihao,Tan, Qian,Guo, Shimeng,Xie, Rongrong,Gao, Lixin,Ru, Hongbo,Zang, Yi,Liu, Hong,Li, Jia,Zhou, Yu. "Discovery and Optimization of Non-bile Acid FXR Agonists as Preclinical Candidates for the Treatment of Nonalcoholic Steatohepatitis". . p. 12748 - 12772. Retrieved 2020/12/17.