4-(Chloromethyl)-2-isopropylthiazole hydrochloride

Base Information

• Chemical Name: 4-(Chloromethyl)-2-isopropylthiazole hydrochloride
• CAS No.: 65386-28-9
• Molecular Formula: C₇H₁₀ClNS*ClH
• Molecular Weight: 212.143
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID50595996
• Mol file: 65386-28-9.mol

Synonyms:65386-28-9;4-(Chloromethyl)-2-isopropylthiazole hydrochloride;4-(Chloromethyl)-2-isopropyl]-4-thiazolyl, Hydrochloride Salt;4-(chloromethyl)-2-propan-2-yl-1,3-thiazole;hydrochloride;4-(Chloromethyl)-2-[isopropyl-1,1,1,3,3,3-d6]-4-thiazolylHydrochlorideSalt;4-(Chloromethyl)-2-isopropylthiazolehydrochloride;SCHEMBL4943059;4-(Chloromethyl)-2-isopropyl]-4-thiazolyl hydrochloride;DTXSID50595996;CSTGNMKKUNFVGV-UHFFFAOYSA-N;Thiazole, 4-(chloromethyl)-2-(1-methylethyl)-, hydrochloride;MFCD07369243;AKOS015898829;4-Chloromethyl-2-isopropylthiazole HCl;DB-073613;(Chloromethyl)-2-isopropylthiazole hydrochloride;4-Chloromethyl-2-isopropyl-thiazole hydrochloride;4-(Chloromethyl)-2-isopropyithiazole hydrochloride;A867680;4-(Chloromethyl)-2-(propan-2-yl)-1,3-thiazole--hydrogen chloride (1/1)

Chemical Property of 4-(Chloromethyl)-2-isopropylthiazole hydrochloride

Chemical Property:

• Vapor Pressure: 0.0752mmHg at 25°C
• Melting Point: 92-94°C
• Boiling Point: 235.8°C at 760 mmHg
• Flash Point: 96.4°C
• PSA: 41.13000
• LogP: 3.80730
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform, Dichloromethane
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 210.9989259
• Heavy Atom Count: 11
• Complexity: 108

Purity/Quality:

97% ^*data from raw suppliers

4-(Chloromethyl)-2-isopropyl]-4-thiazolyl,HydrochlorideSalt ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=NC(=CS1)CCl.Cl
• Uses: 4-(ChloroMethyl)-2-isopropylthiazole hydrochloride is a useful synthetic intermediate.

Technology Process of 4-(Chloromethyl)-2-isopropylthiazole hydrochloride

There total 2 articles about 4-(Chloromethyl)-2-isopropylthiazole hydrochloride 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: 81.0%

→ 4-(Chloromethyl)-2-isopropylthiazole Hydrochloride (65386-28-9)

Guidance literature:

Reference yield: 80.0%

thioisobutyramide (13515-65-6) + 1,3-Dichloroacetone (534-07-6) → 4-(Chloromethyl)-2-isopropylthiazole Hydrochloride (65386-28-9)

Guidance literature:

With sulfuric acid; In acetone; at 70 - 75 ℃; for 4h;

upstream raw materials:

thioisobutyramide

1,3-Dichloroacetone

Refernces

• 1、 -. "SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1,2-a]PYRIDINE-3-CARBOXAMIDE COMPOUNDS AS TYPE III RECEPTOR TYROSINE KINASE INHIBITORS". Page/Page column 68. . Retrieved 2012/06/30.
• 2、 Kempf, Dale J.,Sham, Hing L.,Marsh, Kennan C.,Flentge, Charles A.,Betebenner, David,Green, Brian E.,McDonald, Edith,Vasavanonda, Sudthida,Saldivar, Ayda,Wideburg, Norman E.,Kati, Warren M.,Ruiz, Lisa,Zhao, Chen,Fino, Lynnmarie,Patterson, Jean,Molla, Akhteruzzaman,Plattner, Jacob J.,Norbeck, Daniel W.. "Discovery of ritonavir, a potent inhibitor of HIV protease with high oral bioavailability and clinical efficacy". . p. 602 - 617. Retrieved 2007/10/03.