4-(Chloromethyl)thiazole hydrochloride

Base Information

• Chemical Name: 4-(Chloromethyl)thiazole hydrochloride
• CAS No.: 7709-58-2
• Molecular Formula: C4H4ClNS^.HCl
• Molecular Weight: 170.062
• Hs Code.: 2934100090
• European Community (EC) Number: 672-064-3
• DSSTox Substance ID: DTXSID60376874
• Mol file: 7709-58-2.mol

Synonyms:7709-58-2;4-(Chloromethyl)thiazole hydrochloride;4-(chloromethyl)-1,3-thiazole Hydrochloride;4-(chloromethyl)thiazole hcl;4-chloromethylthiazole hydrochloride;4-(chloromethyl)-1,3-thiazole;hydrochloride;4-(Chloromethyl)thiazole, HCl;4-chloromethylthiazole hcl;D01CBV;C-5997;4-(chloromethyl)thiazolehcl;SCHEMBL122926;DTXSID60376874;NVTBASMQHFMANH-UHFFFAOYSA-N;4-(chloromethyl)thiazole HCl salt;AMY13412;4-(chloromethyl)thiazolehydrochloride;4-chloromethyl thiazole hydrochloride;4-chloromethyl-thiazole hydrochloride;CL2524;MFCD02094738;AKOS008053389;4-chloromethylthiazole monohydrochloride;AB10919;CS-W010784;4-(chloromethyl)-thiazole hydrochloride;4-thiazolylmethyl chloride hydrochloride;AC-37186;AS-45958;4-chloromethyl-1,3-thiazole hydrochloride;C1623;FT-0602283;EN300-14185;A838958;J-513706;4-(Chloromethyl)-1,3-thiazole hydrochloride (1:1)

Chemical Property of 4-(Chloromethyl)thiazole hydrochloride

Chemical Property:

• Vapor Pressure: 0.222mmHg at 25°C
• Melting Point: 186-192°C (dec.)
• Refractive Index: 1.564
• Boiling Point: 214.9 °C at 760 mmHg
• Flash Point: 83.8 °C
• PSA: 41.13000
• Density: 1.338g/cm3
• LogP: 2.68390
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 168.9519757
• Heavy Atom Count: 8
• Complexity: 59.7

Purity/Quality:

98%, ^*data from raw suppliers

4-(Chloromethyl)-1,3-thiazoleHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-41-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(N=CS1)CCl.Cl

Technology Process of 4-(Chloromethyl)thiazole hydrochloride

There total 3 articles about 4-(Chloromethyl)thiazole 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:

→ thiocarboxamide (115-08-2) + 4-(chloromethyl)thiazole hydrochloride (7709-58-2)

Guidance literature:

Reference yield:

thiocarboxamide (115-08-2) + 1,3-Dichloroacetone (534-07-6) → 4-(chloromethyl)thiazole hydrochloride (7709-58-2)

Guidance literature:

DOI:10.1021/ja01150a502

Reference yield:

→ diethyl (4-thiazolyl)methylacetamidemalonate + 4-(chloromethyl)thiazole hydrochloride (7709-58-2)

Guidance literature:

upstream raw materials:

thiocarboxamide

1,3-Dichloroacetone

Downstream raw materials:

tert-butyl (1-(4-(2-oxo-7-phenyl-1-(thiazol-4-ylmethyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-6-yl)phenyl)cyclobutyl)carbamate

(4S)-4-{4-Cyano-2-[(1,3-thiazol-4-ylmethyl)sulfonyl]phenyl}-3,6-dimethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carbonitrile

methyl-[3-(2-nitro-phenylsulfanyl)-1-thiazol-4-ylmethyl-1H-indol-6-yl]-carbamic acid tert-butyl ester

4-[(Cyclopropylmethyl)(1,3-thiazol-4-ylmethyl)amino]-1,2-benzenedicarbonitrile

Refernces

• 1、 -. "INDOLE CARBOXYLATE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS". . . Retrieved 2008/06/13.
• 2、 Watanabe,Kuwata,Sakata,Matsumura. "Studies of unnatural amino acids and their peptides. II. The syntheses of DL-beta-(4-thiazolyl)-alpha-alanine and its peptides.". . p. 2473 - 2476. Retrieved 2007/10/04.