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Chemical Structure| 3585-93-1 Chemical Structure| 3585-93-1

Structure of 3585-93-1

Chemical Structure| 3585-93-1

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Product Details of [ 3585-93-1 ]

CAS No. :3585-93-1
Formula : C14H13NO2
M.W : 227.26
SMILES Code : COC1=CC=C(C=[N+]([O-])C2=CC=CC=C2)C=C1
MDL No. :MFCD00118217

Safety of [ 3585-93-1 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H301-H311-H331
Precautionary Statements:P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Class:6.1
UN#:2811
Packing Group:

Application In Synthesis of [ 3585-93-1 ]

* 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 [ 3585-93-1 ]

[ 3585-93-1 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 3585-93-1 ]
  • [ 13380-67-1 ]
  • 5-(4-bromophenyl)-3-(4-methoxyphenyl)-2-phenyl-cis-3-cis-3a-tetrahydropyrrolo[3,4-d]isoxazole-4,6-dione [ No CAS ]
  • 5-(4-bromophenyl)-3-(4-methoxyphenyl)-2-phenyl-trans-3-cis-3a-tetrahydropyrrolo[3,4-d]isoxazole-4,6-dione [ No CAS ]
YieldReaction ConditionsOperation in experiment
31.3%; 40.1% In benzene; at 40℃; A mixture of C-(4-methoxybenzyl)-N-phenylnitrone (0.300 g, 1.32 mmol), <strong>[13380-67-1]N-(4-bromophenyl)maleimide</strong> (0.333 g, 1.32 mmol) and benzene (2.6 mL) was stirred overnight at 40 C. The resultant suspension was cooled to room temperature and diluted with methylene chloride until a homogeneous mixture was achieved. The mixture was chromatographed (silica gel, 20% ethyl acetate/hexanes). 5-(4-Bromophenyl)-3-(4-methoxyphenyl)-2-phenyl-trans-3-cis-3a-tetrahydropyrrolo[3,4-d]isoxazole-4,6-dione eluted first and was isolated as a tan solid (0.254 g, 40.1%): mp 203-205 C. dec; 1H NMR (300 MHz, CDCl3) δ 7.50 (d, 4H), 7.32 (d, 2H), 7.20 (d, 2H), 7.04 (m, 3H), 6.60 (d, 2H), 5.75 (s, 1H), 5.15 (d, 1H), 4.06 (d, 1H), 3.86 (s, 3H); APCI MS m/z 481 [C24H19BrN2O4+H]+. 5-(4-Bromophenyl)-3-(4methoxyphenyl)-2-phenyl-cis-3-cis-3a-tetrahydropyrrolo[3,4-d]isoxazole-4,6-dione eluted second and was isolated as a tan solid (0.198 g, 31.3% yield): mp 206-208 C. dec; 1H NMR (300 MHz, CDCl3) δ 7.61 (d, 2H), 7.39 (d, 2H), 7.25 (d, 2H), 7.15 (d, 3H), 7.03 (d, 2H), 6.90 (d, 2H), 5.30 (d, 1H), 4.90 (d, 1H), 4.08 (t, 1H), 3.78 (s, 3H); APCI MS m/z 481 [C24H19BrN2O4+H]+.
  • 2
  • [ 3585-93-1 ]
  • [ 501-65-5 ]
  • [ 5782-11-6 ]
  • [ 3469-20-3 ]
 

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