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Chemical Structure| 96184-80-4 Chemical Structure| 96184-80-4

Structure of 96184-80-4

Chemical Structure| 96184-80-4

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Product Details of [ 96184-80-4 ]

CAS No. :96184-80-4
Formula : C10H16O3
M.W : 184.23
SMILES Code : COC=C(CC1)CCC21OCCO2
MDL No. :MFCD09834693

Safety of [ 96184-80-4 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319
Precautionary Statements:P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330

Application In Synthesis of [ 96184-80-4 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Upstream synthesis route of [ 96184-80-4 ]
  • Downstream synthetic route of [ 96184-80-4 ]

[ 96184-80-4 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 96184-80-4 ]
  • [ 96184-81-5 ]
YieldReaction ConditionsOperation in experiment
86.9% With hydrogenchloride; water In 1,4-dioxane at 20℃; for 1 h; Step 2: 4-oxocycIohexanecarbaldehyde; [00179] To a solution of 8-(methoxymethylene)-l,4-dioxaspiro[4.5]decane (30 g, 0.16 mol) in 1,4-dioxane (60 mL) was added H2O (30 mL) and cone. HCl solution (120 mL, 1.4 mol) at room temperature. The mixture was stirred at room temperature for 1 hr. The mixture was partitioned with ethyl acetate (150 mL) and H2O (150 mL), the organic layer was dried over anhydrous Na2SO4, and concentrated under reduced pressure to give a crude 4- oxocyclohexanecarbaldehyde (15.3 g, 86.9percent) as a colorless oil, which was used in the next step without further purification.1H NMR, (400 MHz, CDCl3) δ 9.71 (s, 1 H), 2.64-2.62 (m, 1 H), 2.41-2.29 (m, 5 H), 2.20- 2.15 (m, 2 H), 1.94-1.89 (m, 2 H).
References: [1] Patent: WO2008/94574, 2008, A2, . Location in patent: Page/Page column 50.
[2] Molecular Crystals and Liquid Crystals (1969-1991), 1985, vol. 131, p. 327 - 342.
[3] Patent: US5238602, 1993, A, .
[4] Patent: US4565425, 1986, A, .
[5] Patent: US4915480, 1990, A, .
[6] Patent: US4565425, 1986, A, .
[7] Patent: US4709030, 1987, A, .
 

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