N-Methyl-1-(thiazol-2-yl)methanamine

Base Information

• Chemical Name: N-Methyl-1-(thiazol-2-yl)methanamine
• CAS No.: 144163-68-8
• Molecular Formula: C5H8N2S
• Molecular Weight: 128.198
• Hs Code.: 2934100090
• European Community (EC) Number: 819-108-1
• DSSTox Substance ID: DTXSID50596680
• Nikkaji Number: J3.402.945H
• Wikidata: Q72491222
• Mol file: 144163-68-8.mol

Synonyms:144163-68-8;N-Methyl-1-(thiazol-2-yl)methanamine;N-Methylthiazole-2-methanamine;METHYL-THIAZOL-2-YLMETHYL-AMINE;N-methyl-1-(1,3-thiazol-2-yl)methanamine;2-METHYLAMINOMETHYLTHIAZOLE;2-Thiazolemethanamine, N-methyl-;methyl[(1,3-thiazol-2-yl)methyl]amine;methylthiazol-2-ylmethylamine;METHYL(1,3-THIAZOL-2-YLMETHYL)AMINE;SCHEMBL178402;DTXSID50596680;MNHGOWYUJYMPGV-UHFFFAOYSA-N;AKOS005175080;AB12715;NCGC00374081-01;AS-30841;DB-063527;EN300-96866;N-Methyl-N-[(1,3-thiazol-2-yl)methyl]amine;A808181;F8887-7620;Z802607826

Chemical Property of N-Methyl-1-(thiazol-2-yl)methanamine

Chemical Property:

• Vapor Pressure: 0.855mmHg at 25°C
• Refractive Index: 1.543
• Boiling Point: 181.371 °C at 760 mmHg
• PKA: 7.44±0.10(Predicted)
• Flash Point: 63.491 °C
• PSA: 53.16000
• Density: 1.127 g/cm³
• LogP: 1.25340
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 128.04081944
• Heavy Atom Count: 8
• Complexity: 67.4

Purity/Quality:

98%min ^*data from raw suppliers

N-methyl-1-(1,3-thiazol-2-yl)methanaminedihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCC1=NC=CS1

Technology Process of N-Methyl-1-(thiazol-2-yl)methanamine

There total 3 articles about N-Methyl-1-(thiazol-2-yl)methanamine 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: 18.0%

Thiazole-2-carbaldehyde (10200-59-6) + methylamine hydrochloride (593-51-1) → 2-<(N-methylamino)methyl>thiazole (144163-68-8)

Guidance literature:

With sodium acetate; sodium cyanoborohydride; In isopropyl alcohol; for 72h; Ambient temperature;

DOI:10.1021/jm00055a003

Reference yield:

C5H6N2S → 2-<(N-methylamino)methyl>thiazole (144163-68-8)

Guidance literature:

With sodium tetrahydroborate; In ethanol; for 8h;

DOI:10.1002/ejoc.201402977

Reference yield:

→ 2-<(N-methylamino)methyl>thiazole (144163-68-8)

Guidance literature:

upstream raw materials:

Thiazole-2-carbaldehyde

methylamine hydrochloride

Refernces

• 1、 -. "SORDARIN DERIVATIVES FOR PREVENTING OR TREATING INFECTIOUS DISEASES CAUSED BY PATHOGENIC MICROORGANISMS". Page/Page column 99; 117. . Retrieved 2009/12/05.
• 2、 Kempf, Dale J.,Codacovi, Lynnmarie,Wang, Xiu Chun,Kohlbrenner, William E.,Wideburg, Norman E.,et al.. "Symmetry-Based Inhibitors of HIV Protease. Structure-Activity Studies of Acylated 2,4-Diamino-1,5-diphenyl-3-hydroxypentane and 2,5-Diamino-1,6-diphenylhexane-3,4-diol". . p. 320 - 330. Retrieved 2007/10/02.