2-Amino-4-chloro-5-thiazolecarboxaldehyde
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2-Amino-4-chloro-5-thiazolecarboxaldehyde
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CAS No:
76874-79-8
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Formula:
C4H3ClN2OS
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Chemical Name:
2-Amino-4-chloro-5-thiazolecarboxaldehyde
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Synonyms:
5-Thiazolecarboxaldehyde,2-amino-4-chloro-;2-Amino-4-chloro-5-thiazolecarboxaldehyde;2-Amino-4-chloro-5-formylthiazole;2-Amino-4-chloro-5-formyl-1,3-thiazole;2-Amino-4-chlorothiazole-5-carbaldehyde;2-Amino-4-chloro-1,3-thiazole-5-carbaldehyde
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CAS No:
2-Amino-4-chloro-5-thiazolecarboxaldehyde Basic Attributes
162.6
162.60
616-405-6
DTXSID00452484
2934100090
Safety Information
Xi
|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Amino-4-chloro-5-thiazolecarboxaldehyde Use and Manufacturing
To Step J - Synthesis of(4-chloro-5-formyl-thiazol-2-yl)-carbamic acid tert-butyl ester (589):; [0233] To To a solution of [0184] Into a 1, 4-dioxane solution (250 ml) containing 2-amino-4-chlorothiazol-5-carbaldehyde (10.83 g) was added 4-(dimethylamino)pyridine (1 g). Then, a 1, 4-dioxane solution (100 ml) containing di-tert-butyl dicarbonate (29 g) was gradually added dropwise under heating at 60[deg.] C., and then the whole was continued to stir for about 30 minutes. After the reaction solution was cooled upon standing, the solvent was evaporated under reduced pressure and an appropriate amount of 5% potassium hydrogen sulfate aqueous solution was poured to the thus obtained residue, followed by extraction with ethyl acetate. After the organic layer was washed with water and dried over anhydrous magnesium sulfate, the crude product formed by solvent evaporation was purified by silica gel column chromatography to obtain tert-butyl (4-chloro-5-formylthiazol-2-yl)-carbamate (10.73 g) as pale brown crystals from the fractions eluted with ethyl acetate-toluene (2:3 (v/v)).Add dichloromethane (1325 g, 15.6 mol) to 13 g (0.08 mol) 16.3 parts of
Computed Properties
Molecular Weight:162.60
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:161.9654616
Monoisotopic Mass:161.9654616
Topological Polar Surface Area:84.2
Heavy Atom Count:9
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-Amino-4-chloro-5-thiazolecarboxaldehyde
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