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Chemical Structure| 5963-14-4 Chemical Structure| 5963-14-4

Structure of 8-Methylnonanoic acid
CAS No.: 5963-14-4

Chemical Structure| 5963-14-4

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Synonyms: Isocapric Acid

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Product Details of [ 5963-14-4 ]

CAS No. :5963-14-4
Formula : C10H20O2
M.W : 172.26
SMILES Code : CC(C)CCCCCCC(O)=O
Synonyms :
Isocapric Acid
MDL No. :MFCD00044086

Safety of [ 5963-14-4 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H319
Precautionary Statements:P305+P351+P338

Application In Synthesis of [ 5963-14-4 ]

* 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.

  • Downstream synthetic route of [ 5963-14-4 ]

[ 5963-14-4 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 5963-14-4 ]
  • [ 2305-13-7 ]
  • [ 951221-75-3 ]
YieldReaction ConditionsOperation in experiment
95.4% novozyme 435; at 50℃; for 16h;Enzymatic reaction; Neat (no solvent); 3-(3-Methoxy-4-hydroxyphenyl)propyl alcohol (833 mg, 4.57 mmol), 8-methylnonanoic acid (753 mg, 4.35 mmol) and Novozyme 435 (51 mg) were measured and placed in a flask (25 ml). The mixture was stirred with heating in an oil bath at 50° C. for 16 hr while reducing the pressure by an aspirator. The reaction mixture was allowed to cool to room temperature, n-hexane (25 ml) was added, and Novozyme 435 and the precipitated insoluble material were removed by filtration. N-hexane (50 ml) was added, and the mixture was washed with 5percent aqueous citric acid solution (25 ml.x.2), saturated brine (25 ml), 5percent aqueous sodium hydrogen carbonate solution (25 ml.x.2) and saturated brine (25 ml), and dried over anhydrous magnesium sulfate. Magnesium sulfate was filtered off, and the filtrate was concentrated under reduced pressure. The residue was developed by PTLC (n-hexane:ethyl acetate=3:1), and silica gel containing the object product was stirred with ethyl acetate (100 ml) for 30 min for extraction. The silica gel was filtered off, and the filtrate was concentrated under reduced pressure to give 3-(3-methoxy-4-hydroxyphenyl)propyl 8-methylnonanoate (1.40 g, yield 95.4percent) as a colorless oil.1H-NMR (CDCl3,delta): 0.86 (6H, d, J=6.60 Hz), 1.10-1.20 (2H, m), 1.20-1.38 (6H, m), 1.45-1.60 (1H, m), 1.58-1.65 (2H, m), 1.88-2.00 (2H, m), 2.30 (2H, t, J=7.44 Hz), 2.61 (2H, t, J=7.32 Hz), 3.88 (3H, s), 4.09 (2H, t, J=6.56 Hz), 5.49 (1H, s), 6.65-6.68 (2H, m), 6.83 (1H, d, J=5.2 Hz).
  • 2
  • [ 39207-65-3 ]
  • [ 5963-14-4 ]
  • 3
  • [ 5963-14-4 ]
  • [ 29022-11-5 ]
  • [ 35661-39-3 ]
  • (2S,3S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-(tert-butoxy)-3-methoxy-4-oxobutanoic acid [ No CAS ]
  • C44H46N2O6Si [ No CAS ]
  • [ 71989-14-5 ]
  • [ 71989-26-9 ]
  • [ 73731-37-0 ]
  • [ 104091-08-9 ]
  • [ 77128-70-2 ]
  • [ 143824-78-6 ]
  • C104H154N13O26PolSi [ No CAS ]
 

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