Cas no 36568-11-3 (Octanoic acid, 3,5-dioxo-, ethyl ester)
36568-11-3 structure
Product Name:Octanoic acid, 3,5-dioxo-, ethyl ester
CAS No:36568-11-3
MF:C10H16O4
MW:200.231643676758
CID:1476232
Update Time:2024-08-23
Octanoic acid, 3,5-dioxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Octanoic acid, 3,5-dioxo-, ethyl ester
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- Inchi： 1S/C10H16O4/c1-3-5-8(11)6-9(12)7-10(13)14-4-2/h3-7H2,1-2H3
- InChI Key： NVHCOTWQOUIBQN-UHFFFAOYSA-N
- SMILES： C(OCC)(=O)CC(=O)CC(=O)CCC
Computed Properties
- Exact Mass: 200.10488
Experimental Properties
- Density: 1.046±0.06 g/cm3(Predicted)
- Boiling Point: 276.0±15.0 °C(Predicted)
- PSA: 60.44
- pka: 8.09±0.10(Predicted)
Octanoic acid, 3,5-dioxo-, ethyl ester Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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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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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
36568-11-3 (Octanoic acid, 3,5-dioxo-, ethyl ester) Related Products
- 2052-15-5(Butyl 4-oxopentanoate)
- 4949-44-4(Ethyl 3-oxopentanoate)
- 13984-57-1(Ethyl 5-oxohexanoate)
- 7152-15-0(Ethyl isobutyrylacetate)
- 22502-03-0(2-Methoxyethyl acetoacetate)
- 539-88-8(Ethyl levulinate)
- 105-50-0(Diethyl 3-oxopentanedioate)
- 3249-68-1(Ethyl butyrylacetate)
- 30414-53-0(Methyl 3-oxopentanoate)
- 1830-54-2(Dimethyl acetone-1,3-dicarboxylate)
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