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Chemical Structure| 2696-85-7 Chemical Structure| 2696-85-7

Structure of 2696-85-7

Chemical Structure| 2696-85-7

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Product Details of [ 2696-85-7 ]

CAS No. :2696-85-7
Formula : C10H15N
M.W : 149.23
SMILES Code : NC1=CC=CC=C1CCCC
MDL No. :MFCD00130033
InChI Key :HDVUPIFFKAHPJY-UHFFFAOYSA-N
Pubchem ID :75909

Safety of [ 2696-85-7 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 2696-85-7 ]

* 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 [ 2696-85-7 ]

[ 2696-85-7 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 4565-31-5 ]
  • [ 2696-85-7 ]
  • (E)-5-(((2-butylphenyl)imino)methyl)thiophene-2-carboxylic acid [ No CAS ]
YieldReaction ConditionsOperation in experiment
93% In toluene; for 3h;Reflux; A solution of 2-butylbenzenamine (101?ml, 640.4?mmol) in toluene (100?ml) was added drop-wise to a mixture of 5-formylthiophene-2-carboxylic acid (108; 100?g, 640.4?mmol) in toluene (600?ml) and the resulting mixture heated to reflux for 3?h. After cooling to 90?°C, n-heptane (500?ml) was added and the resulting solution seeded with small crystals of the desired product at 68?°C. After cooling to room temperature, the precipitated solid was filtered and washed with n-heptane (1?L). The filter cake was dried in a vacuum to afford (E)-5-(((2-butylphenyl)imino)methyl)thiophene-2-carboxylic acid (110; 171.5?g, 93percent) as a pale yellow solid. 1H NMR (CDCl3, 400?MHz) delta: 0.93 (t, J?=?7.3?Hz, 3H), 1.33-1.42 (m, 2H), 1.58 (tt, J?=?8.6, 3.6?Hz, 2H), 2.80 (t, J?=?7.8?Hz, 2H), 6.99-7.02 (m, 1H), 7.18-7.27 (m, 3H), 7.47 (d, J?=?3.9?Hz, 1H), 7.90 (d, J?=?3.9?Hz, 1H), 8.53 (s, 1H).
 

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