Cas no 80828-38-2 (Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)-)
![Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)- structure](https://ossimg.kuujia.com/scimg/81000/80828-38-2x500.png)
80828-38-2 structure
Product Name:Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)-
CAS No:80828-38-2
MF:C19H29NO4
MW:335.437865972519
CID:6640943
Update Time:2024-01-29
Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)- Chemical and Physical Properties
Names and Identifiers
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- Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)-
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- Inchi： 1S/C19H29NO4/c1-6-23-18(22)16(13-12-15-10-8-7-9-11-15)20-14(2)17(21)24-19(3,4)5/h7-11,14,16,20H,6,12-13H2,1-5H3/t14-,16-/m0/s1
- InChI Key： VCLNYFQYCONLJF-HOCLYGCPSA-N
- SMILES： C1(CC[C@H](N[C@@H](C)C(OC(C)(C)C)=O)C(OCC)=O)=CC=CC=C1
Experimental Properties
- Density: 1.046±0.06 g/cm3(Predicted)
- Boiling Point: 422.9±45.0 °C(Predicted)
- pka: 4.60±0.39(Predicted)
Benzenebutanoic acid, α-[[(1S)-2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-, ethyl ester, (αS)- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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