[ CAS No. 6186-22-7 ]

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Cat. No.: {[proInfo.prAm]}
2D
Chemical Structure| 6186-22-7
Chemical Structure| 6186-22-7
Structure of 6186-22-7

Quality Control of [ 6186-22-7 ]

Purity: {[proInfo.showProBatch.pb_purity]}

Related Doc. of [ 6186-22-7 ]

SDS

Product Details of [ 6186-22-7 ]

CAS No. :6186-22-7MDL No. :MFCD00210401
Formula :C9H9BrOBoiling Point :265.7±15.0°C at 760 mmHg
Linear Structure Formula :-InChI Key :-
M.W :213.07Pubchem ID :-
Synonyms :

Computed Properties of [ 6186-22-7 ]

TPSA : - H-Bond Acceptor Count : -
XLogP3 : - H-Bond Donor Count : -
SP3 : - Rotatable Bond Count : -

Safety of [ 6186-22-7 ]

Signal Word:WarningClassN/A
Precautionary Statements:P261-P305+P351+P338UN#:N/A
Hazard Statements:H302-H315-H319Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 6186-22-7 ]

  • Upstream synthesis route of [ 6186-22-7 ]

[ 6186-22-7 ] Synthesis Path-Upstream   1~17

  • 1
  • [ 21892-60-4 ]
  • [ 6186-22-7 ]
YieldReaction ConditionsOperation in experiment
94% With hydrogenchloride; iron(III) chloride; iron In water at 20 - 95℃; A mixture of 1-bromo-4-(2-nitroprop-1-en-1-yl)benzene (116.8 g, 0.48 mol), iron powder(228 g, 4.08 mol) and iron (Ill) chloride (2.28 g, 14 mmol) in water (456 ml) was warmedto 65°C and 37percent hydrochloric acid (ca. 20 ml) added dropwise. Heating was stopped andthe mixture slowly exothermed to ca. 95°C. Once the exotherm had subsided, further37percent HCI (ca. 200 ml) was slowly added and the mixture left to stir to room temperature. Ethyl acetate (900 ml) was then added and the mixture stirred for 30 mm. It was then filtered through a pad of celite and the layers separated; the aqueous was extracted with further ethyl acetate (200 ml) and the combined organics washed with brine and driedover magnesium sulphate. After filteration and concentrated to give 2-(4- bromophenyl)acetone (2044550) as an oil (96.5g (94percent)) which was pure enough to use in the following step.
Reference: [1] Patent: WO2017/29104, 2017, A1. Location in patent: Page/Page column 11
[2] Synthesis, 1985, # 6/7, p. 654 - 656
[3] Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1978, p. 995 - 1001
[4] Chimica Therapeutica, 1968, vol. 3, p. 313 - 320
[5] Journal of the American Chemical Society, 1964, vol. 86, p. 684 - 687
[6] Tetrahedron Letters, 1983, vol. 24, # 4, p. 417 - 418
[7] European Journal of Medicinal Chemistry, 2009, vol. 44, # 12, p. 4862 - 4888
  • 2
  • [ 108-22-5 ]
  • [ 106-40-1 ]
  • [ 6186-22-7 ]
Reference: [1] Advanced Synthesis and Catalysis, 2018, vol. 360, # 14, p. 2773 - 2778
[2] Tetrahedron Letters, 2012, vol. 53, # 32, p. 4117 - 4120
[3] Journal of Organic Chemistry, 2012, vol. 77, # 22, p. 10347 - 10352
[4] Journal of the American Chemical Society, 2015, vol. 137, # 28, p. 8892 - 8895
[5] Patent: CN107646855, 2018, A. Location in patent: Paragraph 0006; 0022
  • 3
  • [ 108-22-5 ]
  • [ 106-37-6 ]
  • [ 6186-22-7 ]
Reference: [1] Bulletin of the Chemical Society of Japan, 1984, vol. 57, # 1, p. 241 - 246
  • 4
  • [ 56856-82-7 ]
  • [ 6186-22-7 ]
Reference: [1] Organic Letters, 2010, vol. 12, # 13, p. 2936 - 2939
  • 5
  • [ 75-36-5 ]
  • [ 589-15-1 ]
  • [ 6186-22-7 ]
Reference: [1] Journal of Organic Chemistry, 1985, vol. 50, # 9, p. 1373 - 1381
  • 6
  • [ 4489-23-0 ]
  • [ 6186-22-7 ]
Reference: [1] Journal of the American Chemical Society, 2016, vol. 138, # 37, p. 12037 - 12040
  • 7
  • [ 79-24-3 ]
  • [ 1122-91-4 ]
  • [ 109-73-9 ]
  • [ 6186-22-7 ]
Reference: [1] Patent: US5332757, 1994, A
  • 8
  • [ 108-22-5 ]
  • [ 673-40-5 ]
  • [ 6186-22-7 ]
Reference: [1] Angewandte Chemie - International Edition, 2016, vol. 55, # 27, p. 7676 - 7679[2] Angew. Chem., 2016, vol. 128, p. 7806 - 7810,5
[3] Chemical Communications, 2015, vol. 51, # 73, p. 13902 - 13905
  • 9
  • [ 131981-75-4 ]
  • [ 6186-22-7 ]
Reference: [1] Tetrahedron Letters, 1985, vol. 26, # 32, p. 3777 - 3778
  • 10
  • [ 1122-91-4 ]
  • [ 6186-22-7 ]
Reference: [1] Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1978, p. 995 - 1001
[2] Chimica Therapeutica, 1968, vol. 3, p. 313 - 320
[3] Journal of the American Chemical Society, 1964, vol. 86, p. 684 - 687
[4] Patent: WO2017/29104, 2017, A1
  • 11
  • [ 56856-82-7 ]
  • [ 6186-22-7 ]
Reference: [1] Tetrahedron Letters, 2015, vol. 56, # 23, p. 3373 - 3377
  • 12
  • [ 36681-39-7 ]
  • [ 6186-22-7 ]
Reference: [1] Archiv der Pharmazie, 1975, vol. 308, # 1, p. 41 - 45
  • 13
  • [ 106-40-1 ]
  • [ 6186-22-7 ]
Reference: [1] Chemical Communications, 2015, vol. 51, # 73, p. 13902 - 13905
  • 14
  • [ 108-24-7 ]
  • [ 1878-68-8 ]
  • [ 6186-22-7 ]
Reference: [1] Angewandte Chemie - International Edition, 2016, vol. 55, # 17, p. 5309 - 5312[2] Angew. Chem., 2016, vol. 128, # 17, p. 5395 - 5398,4
  • 15
  • [ 616-47-7 ]
  • [ 1878-68-8 ]
  • [ 6186-22-7 ]
Reference: [1] Chemical Communications, 2016, vol. 52, # 79, p. 11850 - 11853
  • 16
  • [ 108-86-1 ]
  • [ 67-64-1 ]
  • [ 21906-32-1 ]
  • [ 21906-31-0 ]
  • [ 6186-22-7 ]
Reference: [1] Bulletin des Societes Chimiques Belges, 1984, vol. 93, # 10, p. 897 - 902
  • 17
  • [ 37859-24-8 ]
  • [ 506-82-1 ]
  • [ 6186-22-7 ]
Reference: [1] Archiv der Pharmazie, 1992, vol. 325, # 12, p. 751 - 760
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