Cas no 221635-86-5 (Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester)
![Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester structure](https://ossimg.kuujia.com/scimg/222000/221635-86-5x500.png)
221635-86-5 structure
Product Name:Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester
CAS No:221635-86-5
MF:C14H18O3
MW:234.290924549103
CID:1406750
Update Time:2024-08-15
Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester
- Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-, ethyl ester
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- Inchi： 1S/C14H18O3/c1-5-17-11(15)10-8-9-6-7-14(10,4)12(16)13(9,2)3/h6-9H,5H2,1-4H3
- InChI Key： LMUUNNAXRWSGPS-UHFFFAOYSA-N
- SMILES： C12(C)C(=O)C(C)(C)C(C=C1)C=C2C(OCC)=O
Computed Properties
- Exact Mass: 234.12564
Experimental Properties
- Density: 1.108±0.06 g/cm3(Predicted)
- Boiling Point: 317.8±42.0 °C(Predicted)
- PSA: 43.37
Bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid, 1,8,8-trimethyl-7-oxo-,ethyl ester Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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