Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate
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Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate
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CAS No:
259654-73-4
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Formula:
C7H10N2O2S
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Chemical Name:
Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate
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CAS No:
Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate Basic Attributes
186.23
186.046
DTXSID80377025
2934100090
Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate Use and Manufacturing
To a solution of bromide from Step 1 (18 g, 86 [MMOL)] in toluene (100 mL) was added thiourea (10.5 g, 138 [MMOL).] The reaction mixture was heated to [100C] for 1 h, cooled to rt, and the solvent removed under reduced pressure. The residue was dissolved in [CH2CI2] (100 mL), a saturated solution of [NAHC03] (75 mL) was added, and the mixture was vigorously stirred for 10 minutes. The organic layer was separated, dried [(NA2SO4), ] filtered, and concentrated under reduced pressure. The residue was then recrystallized from [CH2CI2/HEXANES] to provide the product (10 g, 63percent) as a white solid. [(C7H10N202S)] : LC-MS, RT 0.76 min, (M+H) [+] 187.0 ;'H NMR [(CDCI3)] : [6] 2.23 (s, 3H), 3.70 (s, 2H), 3.75 (s, 3H), 4.83-4. 95 (broad s, 2H).To a solution of bromide of Example 170 (18 g, 86 mmol) in toluene (100 mL) was added thiourea (10.5 g, 138 mmol). To a solution of bromide of Example 170 (18 g, 86 mmol) in toluene (100 mL) was added thiourea (10.5 g, 138 mmol).
Computed Properties
Molecular Weight:186.23
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:186.04629874
Monoisotopic Mass:186.04629874
Topological Polar Surface Area:93.4
Heavy Atom Count:12
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Methyl 2-(2-amino-5-methylthiazol-4-yl)acetate
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