(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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![(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/56db09d4cd024641b84474433b4559bb.png "(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid")
(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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CAS No:
270065-86-6
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Formula:
C16H20N2O4
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Chemical Name:
(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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Synonyms:
Benzenebutanoic acid,3-cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]-,(βS)-;(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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CAS No:
(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid Basic Attributes
304.34
304.34
Computed Properties
Molecular Weight:304.34
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:304.14230712
Monoisotopic Mass:304.14230712
Topological Polar Surface Area:99.4
Heavy Atom Count:22
Complexity:447
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(βS)-3-Cyano-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenebutanoic acid
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