MOC-D-Valine
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MOC-D-Valine
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CAS No:
171567-86-5
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Formula:
C7H13NO4
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Chemical Name:
MOC-D-Valine
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Synonyms:
MOC-D-Valine;(2R)-2-(methoxycarbonylamino)-3-methylbutanoic acid;(R)-2-(Methoxycarbonylamino)-3-methylbutanoic acid;(R)-2-((Methoxycarbonyl)aMino)-4-Methylbutanoic acid;(R)-(+)-N-(Methoxycarbonyl)valine;Methoxycarbonyl-D-Valine;N-METHOXYCARBONYL-D-VALINE
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CAS No:
MOC-D-Valine Use and Manufacturing
NaSodium carbonate (276 mg, 2.6 mmol) was dissolved in an aqueous sodium hydroxide solution (5 mL of 1 M / H 2 O, 5 mmol) of D-vailine (586 mg, 5.00 mmol) The reaction mixture was cooled in an ice-water bath. Methylene chloroformate (0.420 mL, 5.40 mmol) was added portionwise, The ice bath was removed and the reaction mixture was stirred at room temperature for 3.25 hours. The reaction mixture was washed with ether (3 X 9 mL), the water layer was cooled in an ice bath, Conc.HCl was added to acidify to pH 1-2 and extracted with dichloromethane (3 X 9 mL). The organic layer was dried over anhydrous magnesium sulfate, filtered, and then concentrated in vacuo to give the desired compound (760 mg, 87percent yield) as a white solid.
Computed Properties
Molecular Weight:175.18
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:175.08445790
Monoisotopic Mass:175.08445790
Topological Polar Surface Area:75.6
Heavy Atom Count:12
Complexity:178
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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