BENZOYL-DL-VALINE
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BENZOYL-DL-VALINE
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CAS No:
2901-80-6
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Formula:
C12H15NO3
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Chemical Name:
BENZOYL-DL-VALINE
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Synonyms:
Benzoylvaline;N-Benzoylvaline;N-BENZOYL-DL-VAL;BENZOYL-DL-VALINE;valine,N-benzoyl-;IFLAB-BBF1924-0012;N-BENZOYL-DL-VALINE;N-BenzoylvalineBenzoylvaline;rac-(R*)-N-Benzoyl-2-isopropylglycine;2-(BENZOYLAMINO)-3-METHYLBUTANOICACID
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CAS No:
BENZOYL-DL-VALINE Use and Manufacturing
Step A: A solution of 2-amino-3-methylbutanoic acid (500 mg, 4.27 mmol) in 2N NaOH (2.35 ml, 4.69 mmol) was stirred at RT for 30 minutes, then the reaction mixture was cooled at 0°C and benzoyl chloride (471 μ, 4.05 mmol) and 2N NaOH (2.35 ml, 4.69 mmol) were simultaneously added dropwise from two different syringes. The reaction was stirred at RT for 3h. Water was added, the aqueous phase was washed with EtA solution of 2-amino-3-methylbutanoic acid (500 mg, 4.27 mmol) in 2N NaOH (2.35 ml, 4.69 mmol) was stirred at RT for 30 minutes, then the reaction mixture was cooled at 0° C., and benzoyl chloride (471 μl, 4.05 mmol) and 2N NaOH (2.35 ml, 4.69 mmol) were simultaneously added dropwise from two different syringes. The reaction was stirred at RT for 3 hours. Water was added, the aqueous phase was washed with Et
Computed Properties
Molecular Weight:221.25
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:221.10519334
Monoisotopic Mass:221.10519334
Topological Polar Surface Area:66.4
Heavy Atom Count:16
Complexity:257
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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