BOC-1,3-CIS-ACHC-OH

Base Information

• Chemical Name: BOC-1,3-CIS-ACHC-OH
• CAS No.: 222530-34-9
• Molecular Formula: C12H21 N O4
• Molecular Weight: 243.303
• Hs Code.: 2924297099
• Mol file: 222530-34-9.mol

Synonyms:(1S,3R)-3-((tert-butoxycarbonyl)amino)cyclohexanecarboxylic acid;

Chemical Property of BOC-1,3-CIS-ACHC-OH

Chemical Property:

• Vapor Pressure: 2.12E-07mmHg at 25°C
• Boiling Point: 396.7oC at 760 mmHg
• PKA: 4.62±0.10(Predicted)
• Flash Point: 193.7oC
• PSA: 75.63000
• Density: 1.12
• LogP: 2.54540
• Storage Temp.: 2-8°C

Purity/Quality:

98%,99%, ^*data from raw suppliers

(1S,3R)-3-(tert-Butoxycarbonylamino)cyclohexanecarboxylic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: (1S,3R)-3-(tert-Butoxycarbonylamino)cyclohexanecarboxylic Acid is used in preparation of indazolyl-pyrimidines and related heterocycles as CDK inhibitors and their use as pharmaceuticals.

Technology Process of BOC-1,3-CIS-ACHC-OH

There total 19 articles about BOC-1,3-CIS-ACHC-OH 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: 99.0%

(1S,3R)-benzyl 3-((tert-butoxycarbonyl)amino)cyclohexanecarboxylate → (1S,3R)-3-((tert-butoxycarbonyl)amino)cyclo hexane-1-carboxylic acid (222530-34-9,218772-92-0,222530-33-8)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; for 18h; under 760.051 Torr;

Reference yield: 84.0%

(S)-1-phenylethanaminium (1S,3R)-3-((tert-butoxycarbonyl)amino)cyclohexane-carboxylate → (1S,3R)-3-((tert-butoxycarbonyl)amino)cyclo hexane-1-carboxylic acid (222530-34-9,218772-92-0,222530-33-8)

Guidance literature:

In water; ethyl acetate; Inert atmosphere;

DOI:10.1021/acs.jmedchem.0c01754

Reference yield: 75.0%

→ (1S,3R)-3-((tert-butoxycarbonyl)amino)cyclo hexane-1-carboxylic acid (222530-34-9,218772-92-0,222530-33-8)

Guidance literature:

With potassium carbonate; In water; acetone; at 20 ℃; for 16h;

upstream raw materials:

di-tert-butyl dicarbonate

(+/-)-cis-3-aminocyclohexanecarboxylic acid

meta-aminobenzoic acid

cis-1,3-Cyclohexanedicarboxylic acid diethyl ester

Refernces

• 1、 Barlaam, Bernard,Casella, Robert,Cidado, Justin,Cook, Calum,De Savi, Chris,Dishington, Allan,Donald, Craig S.,Drew, Lisa,Ferguson, Andrew D.,Ferguson, Douglas,Glossop, Steve,Grebe, Tyler,Gu, Chungang,Hande, Sudhir,Hawkins, Janet,Hird, Alexander W.,Holmes, Jane,Horstick, James,Jiang, Yun,Lamb, Michelle L.,McGuire, Thomas M.,Moore, Jane E.,O'Connell, Nichole,Pike, Andy,Pike, Kurt G.,Proia, Theresa,Roberts, Bryan,San Martin, Maryann,Sarkar, Ujjal,Shao, Wenlin,Stead, Darren,Sumner, Neil,Thakur, Kumar,Vasbinder, Melissa M.,Varnes, Jeffrey G.,Wang, Jianyan,Wang, Lei,Wu, Dedong,Wu, Liangwei,Yang, Bin,Yao, Tieguang. "Discovery of AZD4573, a Potent and Selective Inhibitor of CDK9 That Enables Short Duration of Target Engagement for the Treatment of Hematological Malignancies". supporting information. p. 15564 - 15590. Retrieved 2021/01/09.
• 2、 -. "Chemical Compounds". . . Retrieved 2017/01/19.