Home Cart Sign in  
Chemical Structure| 1159825-06-5 Chemical Structure| 1159825-06-5

Structure of 1159825-06-5

Chemical Structure| 1159825-06-5

*Storage: {[sel_prStorage]}

*Shipping: {[sel_prShipping]}

,{[proInfo.pro_purity]}

4.5 *For Research Use Only !

{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]} Purity: {[proInfo.pro_purity]}

Change View

Size Price VIP Price

US Stock

Global Stock

In Stock
{[ item.pr_size ]} Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate,item.pr_is_large_size_no_price, item.vip_usd) ]}

US Stock: ship in 0-1 business day
Global Stock: ship in 5-7 days

  • {[ item.pr_size ]}

In Stock

- +

Please Login or Create an Account to: See VIP prices and availability

US Stock: ship in 0-1 business day
Global Stock: ship in 2 weeks

  • 1-2 Day Shipping
  • High Quality
  • Technical Support
Product Citations

Alternative Products

Product Details of [ 1159825-06-5 ]

CAS No. :1159825-06-5
Formula : C3H6ClF2NO2
M.W : 161.54
SMILES Code : O=C(O)C(F)(F)CN.[H]Cl
MDL No. :MFCD11501119
InChI Key :YYNGRYXSTNHZQA-UHFFFAOYSA-N
Pubchem ID :50998843

Safety of [ 1159825-06-5 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501

Application In Synthesis of [ 1159825-06-5 ]

* 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 [ 1159825-06-5 ]

[ 1159825-06-5 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 1159825-06-5 ]
  • [ 1455091-23-2 ]
  • [ 1455088-29-5 ]
YieldReaction ConditionsOperation in experiment
51% With sodium methylate; In methanol; at 130℃; for 2.5h;Microwave irradiation; l-Cyano-4-hydroxy-7-phenoxy-isoquinoline-3-carboxylic acid methyl ester (75 mg, 0.234 mmol) and 3-Amino-2,2-difluoro-propionic acid hydrochloride (122 mg, 0.75 mmol) were placed in a CEM 10 mL Microwave vessel and sodium methoxide-methanol solution (0.5M; 3 mL, 1.5 mmol) was added via syringe. The vessel was sealed and heated to 130 C in a CEM microwave apparatus for 150 minutes. The reaction mixture was diluted with water and treated with IN hydrochloric acid and extracted three times with ethyl acetate then dried over sodium sulfate. The solvent was removed in vacuo to provide the title compound as an orange solid in 51% yield.
  • 2
  • [ 64-17-5 ]
  • [ 1159825-06-5 ]
  • ethyl 3-amino-2,2-difluoropropanoate hydrochloride [ No CAS ]
YieldReaction ConditionsOperation in experiment
920 mg Reference Example 3-1 Ethyl 3-amino-2,2-difluoropropanoate hydrochloride To ethanol (12.0 mL), thionyl chloride (0.587 mL) was added at 0C and the mixture was stirred at that temperature for 30 minutes. After adding <strong>[1159825-06-5]3-amino-2,2-difluoropropionic acid hydrochloride</strong> (950 mg) at 0C, the mixture was refluxed for 4 hours. After being cooled to room temperature, the mixture was concentrated under reduced pressure. After adding ethyl acetate, the resulting precipitate was removed by filtration. The filtrate was concentrated under reduced pressure to give the titled compound as a pale brown oil (920 mg). 1H NMR (300 MHz, CHLOROFORM-d) delta ppm 1.36 (t, J=7.0 Hz, 3 H) 3.84 (t, J=14.1 Hz, 2 H) 4.40 (q, J=7.0 Hz, 2 H) 8.70 (br. s., 3 H). MS ESI/APCI Dual posi: 154[M+H]+.
  • 3
  • [ 1381949-87-6 ]
  • [ 1159825-06-5 ]
  • C21H29F2N3O6 [ No CAS ]
YieldReaction ConditionsOperation in experiment
320 mg Step 1. (0949) To a stirred solution of <strong>[1159825-06-5]3-amino-2,2-difluoro-propionic acid hydrochloride salt</strong> (400 mg, 1.10 mmol) in DCM (5 mL) was added DIPEA (142 mg, 1.10 mmol) at 0 C., sequentially followed by a solution of compound S (350 mg, 1 mmol) in DCM (5 mL). The reaction mixture was stirred at 0 C. for five minutes. Then NaBH(OAc)3 was added to the mixture. The resulting mixture was stirred at rt overnight. The reaction mixture was partitioned between DCM and water. The organic layer was separated, dried over Na2SO4, concentrated in vacuum and isolated to give compound 96-A-1 (320 mg).
 

Historical Records