Cas no 182486-32-4 (Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate)
182486-32-4 structure
Product Name:Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate
CAS No:182486-32-4
MF:C10H19NO4
MW:217.26216340065
CID:113862
Update Time:2023-08-02
Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate Chemical and Physical Properties
Names and Identifiers
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- Propanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, methyl ester, (2R)-
- Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, methyl
- Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate
- (S)-Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate
- (R)-Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate
-
- Inchi： 1S/C10H19NO4/c1-7(8(12)14-5)6-11-9(13)15-10(2,3)4/h7H,6H2,1-5H3,(H,11,13)
- InChI Key： JZHNQALXNGWKCG-UHFFFAOYSA-N
- SMILES： O(C(NCC(C(=O)OC)C)=O)C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 232
- XLogP3: 1.3
- Topological Polar Surface Area: 64.599
Methyl 3-((tert-butoxycarbonyl)amino)-2-methylpropanoate Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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