Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate
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![Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9c98f73d397c423aa0a4a526d0dedab4.png "Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate")
Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate
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CAS No:
79069-16-2
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Formula:
C16H23NO5
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Chemical Name:
Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate
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Synonyms:
Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-,phenylmethyl ester,(3S)-;Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-,phenylmethyl ester,(S)-;Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate;(S)-Benzyl 3-(tert-butoxycarbonylamino)-4-hydroxybutyrate;Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate;(S)-3-tert-Butoxycarbonylamino-4-hydroxybutyric acid benzyl ester;(S)-Benzyl 3-(tert-butoxycarbonylamino)-4-hydroxybutanoate;(3S)-[(tert-Butoxycarbonyl)amino]-4-hydroxybutanoic acid benzyl ester;Benzyl (3S)-3-[(tert-butoxycarbonyl)amino]-4-hydroxybutanoate;(4S)-3-[(tert-Butoxycarbonyl)amino]-4-hydroxybutanoic acid benzyl ester;1097325-59-1
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CAS No:
Phenylmethyl (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxybutanoate Basic Attributes
309.36
309.36
Characteristics
1.154±0.06 g/cm3
57 °C @ Solvent: Ethyl acetate, Cyclohexane
467.4±45.0 °C(Predicted)
11.53±0.46
Computed Properties
Molecular Weight:309.36
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:309.15762283
Monoisotopic Mass:309.15762283
Topological Polar Surface Area:84.9
Heavy Atom Count:22
Complexity:358
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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