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Chemical Structure| 1060811-66-6 Chemical Structure| 1060811-66-6

Structure of 1060811-66-6

Chemical Structure| 1060811-66-6

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Product Details of [ 1060811-66-6 ]

CAS No. :1060811-66-6
Formula : C6H5ClN2O2
M.W : 172.57
SMILES Code : O=C(C1C=CC(N)=NC=1Cl)O
MDL No. :MFCD09838959
InChI Key :USUMQEZUENCWOG-UHFFFAOYSA-N
Pubchem ID :72210839

Safety of [ 1060811-66-6 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Application In Synthesis of [ 1060811-66-6 ]

* 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 [ 1060811-66-6 ]

[ 1060811-66-6 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 124-38-9 ]
  • [ 1221398-11-3 ]
  • [ 1060811-66-6 ]
YieldReaction ConditionsOperation in experiment
A solution of 37 (200mg, 0.79mmol) in anhydrous THF/ Et2O (1:1, 12.5mL) was cooled to-110C on an EtOH/liquid N2 bath. n-BuLi (2.5M in hexanes, 0.69mL, 1.73mmol) was added dropwise and after 15min, CO2 (g) was bubbled through the solution for 35min while the temperature was allowed to rise to-30C. H2O (10mL) was added, and the phases were separated. The organic phase was extracted with H2O (4×10mL) and 1M NaOH (10mL). The combined aqueous layer was acidified with 6M HCl till pH 2 and evaporated partly under vacuum until precipitation occurred. The precipitate was isolated by filtration and dried under vacuum affording the product as brown solid (30mg, 22%). mp (decomp.) >264C. 1H NMR (DMSO-d6) delta 12.57 (b s, 1H), 7.88 (d, J=8.5Hz, 1H), 7.05 (b s, 2H), 6.39 (d, J=8.5Hz, 1H). 13C NMR (DMSO-d6) delta 165.3, 161.0, 149.4, 141.8, 111.9, 106.0. Anal. (C6H5Cl N2O2) C, H, N.
 

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