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Chemical Structure| 113538-80-0 Chemical Structure| 113538-80-0

Structure of 113538-80-0

Chemical Structure| 113538-80-0

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Product Details of [ 113538-80-0 ]

CAS No. :113538-80-0
Formula : C12H14O2
M.W : 190.24
SMILES Code : C=CC1=CC=C(C=C1)COCC2CO2
MDL No. :MFCD00674039
InChI Key :ZADXFVHUPXKZBJ-UHFFFAOYSA-N
Pubchem ID :11830219

Safety of [ 113538-80-0 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H315-H317-H340-H410
Precautionary Statements:P201-P202-P264-P273-P280-P302+P352-P312-P332+P313-P391-P405-P501
Class:9
UN#:3082
Packing Group:

Application In Synthesis of [ 113538-80-0 ]

* 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 [ 113538-80-0 ]

[ 113538-80-0 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 2488-01-9 ]
  • [ 113538-80-0 ]
  • 1,4-bis(dimethyl(4-((oxiran-2-ylmethoxy)methyl)phenethyl)silyl)benzene [ No CAS ]
YieldReaction ConditionsOperation in experiment
90% With platinum(0)-1,3-divinyl-1,1,3,3-tetramethyldisiloxane complex; In 5,5-dimethyl-1,3-cyclohexadiene; at 0 - 20℃; for 3.16667h;Inert atmosphere; Platinum(0)-1,3-divinyl-1,1,3,3-tetramethyl disiloxane complex in xylene [2 wt%] (0.02 mL, 0.9 mmol) was added to a mixture of <strong>[2488-01-9]1,4-bis(dimethylsilyl)benzene</strong> (978 mg, 5.03 mmol) and 4-vinylbenzyl glycidylehter (1.90 g, 9.99 mmol) at 0 C under a N2 atmosphere. After stirring for 10 min, the reaction mixture was allowed to warm to room temperature and stirred for 3h. The reaction mixture was purified by silica column chropatography using hexane-ether (2:1) as an eluent to give a colorless oil (2.57 g, 90%). 1H NMR (400 MHz, CDCl3, δ, ppm): 7.53 (s, 4H), 7.24 (d, J = 6.3 Hz, 4 H), 7.16 (d, J =6.3 Hz, 4 H), 4.54 (quart., J = 8.4 Hz, 4 H), 3.73 (dd, J = 8.7 and 2.4 Hz, 2H), 3.41 (m, 2H), 3.18 (m, 2H), 2.79 (t, J = 3.9 Hz, 2H), 2.66-2.61 (m, 6H) 1.11, (m, 4H), 0.29 (s, 12H). 13C NMR (100 MHz, CDCl3, δ, ppm): 144.80, 139.84, 133.05, 128.08, 127.96, 73.33, 70.75, 51.02, 44.47, 29.79, 17.76, -3.02. 29Si NMR (400 MHz, CDCl3, δ, ppm): 3.02. ATR-FTIR (ν, cm-1): 2951, 1513, 1417, 1380, 1248, 1133, 1090, 1019, 902, 834, 811, 767, 691. HRMS [FAB] m/z Calcd. for C34H46O4Si2: 574.2935, Found: [M+] 574.2925.
 

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