Cas no 658688-02-9 (L-Aspartic acid, N-(1-oxo-4-pentenyl)-, 4-methyl ester)
658688-02-9 structure
Product Name:L-Aspartic acid, N-(1-oxo-4-pentenyl)-, 4-methyl ester
CAS No:658688-02-9
MF:C10H15NO5
MW:229.229803323746
CID:1693814
Update Time:2024-09-02
L-Aspartic acid, N-(1-oxo-4-pentenyl)-, 4-methyl ester Chemical and Physical Properties
Names and Identifiers
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- L-Aspartic acid, N-(1-oxo-4-pentenyl)-, 4-methyl ester
- L-Aspartic acid, N-(1-oxo-4-penten-1-yl)-, 4-methyl ester
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- Inchi： 1S/C10H15NO5/c1-3-4-5-8(12)11-7(10(14)15)6-9(13)16-2/h3,7H,1,4-6H2,2H3,(H,11,12)(H,14,15)/t7-/m0/s1
- InChI Key： JAGYLRGHNNGUSG-ZETCQYMHSA-N
- SMILES： C(O)(=O)[C@H](CC(OC)=O)NC(=O)CCC=C
Computed Properties
- Exact Mass: 228.08722
Experimental Properties
- Density: 1.187±0.06 g/cm3(Predicted)
- Boiling Point: 467.0±45.0 °C(Predicted)
- PSA: 95.53
- pka: 3.02±0.10(Predicted)
L-Aspartic acid, N-(1-oxo-4-pentenyl)-, 4-methyl ester Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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