Methyl β-carboline-1-carboxylate

Base Information

• Chemical Name: Methyl β-carboline-1-carboxylate
• CAS No.: 3464-66-2
• Molecular Formula: C13H10N2O2
• Molecular Weight: 226.235
• Hs Code.: 2933990090
• Mol file: 3464-66-2.mol

Synonyms:Kumujan B;TOB-5;

Chemical Property of Methyl β-carboline-1-carboxylate

Chemical Property:

• Vapor Pressure: 6.91E-09mmHg at 25°C
• Melting Point: 165.3-166 °C
• Boiling Point: 466.7°Cat760mmHg
• PKA: 14.17±0.40(Predicted)
• Flash Point: 236.1°C
• PSA: 54.98000
• Density: 1.353g/cm³
• LogP: 2.50270
• Storage Temp.: 2-8°C

Purity/Quality:

≥98% ^*data from raw suppliers

1-Methoxycarbonyl-beta-Carboline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl β-carboline-1-carboxylate

There total 13 articles about Methyl β-carboline-1-carboxylate 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: 88.0%

9-methoxymethyl-9H-β-carboline-1-carboxylic acid methyl ester → methyl 9H-pyrido[3,4-b]indole-1-carboxylate (3464-66-2)

Guidance literature:

With methanol; trifluorormethanesulfonic acid; trimethyl orthoformate; In nitromethane; at 100 ℃; for 1h;

DOI:10.3987/com-02-s(m)26

Reference yield: 87.0%

methyl 1,2,3,4-tetrahydro-β-carboline-1-carboxylate hydrochloride (108061-48-9) → methyl 9H-pyrido[3,4-b]indole-1-carboxylate (3464-66-2)

Guidance literature:

With 2,2,6,6-tetramethyl-piperidine; sulfur; In xylene; for 5h; Heating;

DOI:10.1139/v01-092

Reference yield: 86.7%

methyl 2,3,4,9-tetrahydro-1H-pyrido [3,4-b]indole-1-carboxylate (127661-45-4,130659-45-9) → methyl 9H-pyrido[3,4-b]indole-1-carboxylate (3464-66-2)

Guidance literature:

With potassium permanganate; In N,N-dimethyl-formamide; at 20 ℃; for 24h;

DOI:10.1016/j.bmcl.2012.05.053

upstream raw materials:

methanol

9H-pyrido<3,4-b>indole-1-carboxylic acid

4-methoxy-5-hydroxyl-canthin-6-one

4,5-dimethoxy-canthin-6-one

Downstream raw materials:

C₁₈H₁₄N₄O₃S

C₁₉H₁₆N₄O₃S

C₁₈H₁₃FN₄O₃S

9H-pyrido[3,4-b]indole-1-carboxamide

Refernces

• 1、 Agarwal, Alka,Agarwal, Shiv K.,Singh, Som Nath,Fatma, Nigar,Chatterjee. "In vivo potent antifilarial ss-carbolines". . p. 225 - 228. Retrieved 1996.
• 2、 Sheng, Tao,Kong, Mengmeng,Wang, Yujie,Wu, HuiJun,Gu, Qin,Chuang, Anita Shyying,Li, Shengkun,Gao, Xuewen. "Discovery and preliminary mechanism of 1-carbamoyl β-carbolines as new antifungal candidates". . . Retrieved 2021/06/21.
• 3、 -. "pityriacitrin Alkaloid derivative containing acylhydrazone structure, and preparation method and application thereof". Paragraph 0031; 0033; 0040. . Retrieved 2021/09/29.