Cas no 662152-00-3 (4H-1,3-Dioxin-6-hexanoic acid, 2,2-dimethyl-4-oxo-, methyl ester)
662152-00-3 structure
Product Name:4H-1,3-Dioxin-6-hexanoic acid, 2,2-dimethyl-4-oxo-, methyl ester
CAS No:662152-00-3
MF:C13H20O5
MW:256.294904708862
CID:1705591
Update Time:2024-08-31
4H-1,3-Dioxin-6-hexanoic acid, 2,2-dimethyl-4-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- 4H-1,3-Dioxin-6-hexanoic acid, 2,2-dimethyl-4-oxo-, methyl ester
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- Inchi： 1S/C13H20O5/c1-13(2)17-10(9-12(15)18-13)7-5-4-6-8-11(14)16-3/h9H,4-8H2,1-3H3
- InChI Key： BVVRIDYGYVIXFH-UHFFFAOYSA-N
- SMILES： O1C(CCCCCC(OC)=O)=CC(=O)OC1(C)C
Computed Properties
- Exact Mass: 256.1311
Experimental Properties
- Density: 1.075±0.06 g/cm3(Predicted)
- Boiling Point: 361.7±42.0 °C(Predicted)
- PSA: 61.83
4H-1,3-Dioxin-6-hexanoic acid, 2,2-dimethyl-4-oxo-, methyl ester Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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