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Type HazMat fee for 500 gram (Estimated)
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Chemical Structure| 17875-18-2 Chemical Structure| 17875-18-2
Chemical Structure| 17875-18-2

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Synonyms: 3-Butenylamine hydrochloride

4.5 *For Research Use Only !

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Product Details of 3-Butenylamine HCl

CAS No. :17875-18-2
Formula : C4H10ClN
M.W : 107.58
SMILES Code : C=CCCN.[H]Cl
Synonyms :
3-Butenylamine hydrochloride
MDL No. :MFCD05663670
InChI Key :MKEXLMVYRUNCQJ-UHFFFAOYSA-N
Pubchem ID :12363007

Safety of 3-Butenylamine HCl

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H301-H315-H318-H334-H335
Precautionary Statements:P280-P301+P310+P330-P302+P352-P305+P351+P338+P310
Class:6.1
UN#:2811
Packing Group:

Application In Synthesis of 3-Butenylamine HCl

* 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 [ 17875-18-2 ]

[ 17875-18-2 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 15855-06-8 ]
  • [ 17875-18-2 ]
  • [ 852878-37-6 ]
YieldReaction ConditionsOperation in experiment
To a solution of 3.87 g (53 mmol, 10 eq) but-3-enylamine hydrochloride in 13.3 ml (53 mmol, 10 eq) 4 N aqueous sodium hydroxide 1.0 g (5.3 mmol, 1 eq) 2-Chloro-6-methoxy-isonicotinic acid and 1.33 g (5.3 mmol, 1 eq) copper(II)sulfate pentahydrate are added and the reaction is heated in a closed vessel during 18 h at a bath temperature of 160 C. After cooling to rt the mixture is diluted 400 ml aqueous 10% citric acid and extracted with EtOAc. The extracts are washed with water and brine, dried over sodium sulfate and the solvents are evaporated at reduced pressure. The residue is dissolved in hot DCM/MeOH. After cooling the inorganic precipitates are filtered off (repeated twice) to give the crude product. This is stirred in water, filtered off and dried in vacuum. A further amount of the product is obtained from the residue of the evaporated washing water by chromatography on silica (short column, flashmaster, DCM to DCM/MeOH 85/15).MS (LC/MS): 223=[M+H]+ 1H-NMR (400 MHz, CDCl3): 6.90 (t, 1H), 6.53 (s, 1H), 6.24 (s, 1H), 5.92-5.82 (m, 1H), 5.10 (d, 1H), 5.04 (d, 1H), 3.81 (s, 3H), 3.35-3.30 (m, 2H), 2.34-2.29 (m, 2H).
  • 2
  • [ 17875-18-2 ]
  • [ 47375-34-8 ]
  • tert-butyl (S)-(1-(but-3-en-1-ylamino)-3-(4-(tert-butoxy)phenyl)-1-oxopropan-2-yl)carbamate [ No CAS ]
 

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