Cas no 1262860-68-3 (4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester)
![4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester structure](https://ossimg.kuujia.com/scimg/1263000/1262860-68-3x500.png)
1262860-68-3 structure
Product Name:4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester
CAS No:1262860-68-3
MF:C12H17NO5
MW:255.267083883286
CID:2126287
Update Time:2023-11-19
4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- ethyl 5-(tert-butoxycarbonyl)-2-methyloxazole-4-carboxylate
- CID 121002849
- 4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester
-
- Inchi： 1S/C12H17NO5/c1-6-16-10(14)8-9(17-7(2)13-8)11(15)18-12(3,4)5/h6H2,1-5H3
- InChI Key： MQRPXPGIZCRGNS-UHFFFAOYSA-N
- SMILES： O(C(C1=C(C(=O)OCC)N=C(C)O1)=O)C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 323
- Topological Polar Surface Area: 78.6
Experimental Properties
- Density: 1.200±0.06 g/cm3(Predicted)
- Boiling Point: 331.1±27.0 °C(Predicted)
- pka: 11.88±0.70(Predicted)
4-Oxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl 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
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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