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Chemical Structure| 53312-78-0 Chemical Structure| 53312-78-0

Structure of 53312-78-0

Chemical Structure| 53312-78-0

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Product Details of [ 53312-78-0 ]

CAS No. :53312-78-0
Formula : C7H5ClN2
M.W : 152.58
SMILES Code : N#CC1=CC(Cl)=CC(N)=C1
MDL No. :MFCD06797224
InChI Key :JRBVDAQXMNYPHC-UHFFFAOYSA-N
Pubchem ID :11030024

Safety of [ 53312-78-0 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 53312-78-0 ]

* 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.

  • Upstream synthesis route of [ 53312-78-0 ]

[ 53312-78-0 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 34662-30-1 ]
  • [ 53312-78-0 ]
YieldReaction ConditionsOperation in experiment
40% With tin(ll) chloride In N,N-dimethyl-formamide at 20℃; 3-Chloro-5-nitrobenzonitrile was reduced to 3-amino-5-chlorobenzonitrile by treating with 6 equivalents of SnCl2 dihydrate in DMF at RT overnight. The product was purified by chromatography over silica gel (40percent yield). LCMS (Cond. A) RT 1.61 min., MH+ 153. 1H NMR (500 MHz, CDCl3) δ 6.97 (s, 1H), 6.84 (t, J=2.0 Hz, 1H), 6.77 (s, 1H).
References: [1] Patent: US2006/287287, 2006, A1, . Location in patent: Page/Page column 17-18.
 

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