(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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![(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b00b92db5b9b4d6baa1172fd20bcb236.png "(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid")
(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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CAS No:
270596-42-4
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Formula:
C15H20ClNO4
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Chemical Name:
(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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Synonyms:
Benzenebutanoic acid,4-chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]-,(βS)-;(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid;(3S)-3-[(tert-Butoxycarbonyl)amino]-4-(4-chlorophenyl)butanoic acid;(3S)-4-(4-Chlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;(S)-3-((tert-Butoxycarbonyl)amino)-4-(4-chlorophenyl)butanoicacid
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CAS No:
(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid Basic Attributes
313.78
313.78
2924299090
Computed Properties
Molecular Weight:313.77
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:313.1080858
Monoisotopic Mass:313.1080858
Topological Polar Surface Area:75.6
Heavy Atom Count:21
Complexity:359
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(βS)-4-Chloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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