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2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester

Base Information
  • Chemical Name:2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester
  • CAS No.:149125-61-1
  • Molecular Formula:C12H12O3
  • Molecular Weight:204.225
  • Hs Code.:
  • DSSTox Substance ID:DTXSID30466877
  • Nikkaji Number:J617.068D
  • Wikidata:Q82293532
  • Mol file:149125-61-1.mol
2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester

Synonyms:149125-61-1;2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester;Methyl 4-phenylmethoxybut-2-ynoate;METHYL 4-(BENZYLOXY)BUT-2-YNOATE;4-(Benzyloxy)-2-butynoic acid methyl ester;methyl 4-(benzyloxy)-2-butynoate;starbld0049092;DTXSID30466877;AKOS030254828;4-phenylmethoxy-but-2-ynoic acid methyl ester

Suppliers and Price of 2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • TRC
  • 4-(Benzyloxy)-2-butynoicAcidMethylEster
  • 10g
  • $ 1440.00
  • TRC
  • 4-(Benzyloxy)-2-butynoicAcidMethylEster
  • 5g
  • $ 870.00
  • TRC
  • 4-(Benzyloxy)-2-butynoicAcidMethylEster
  • 1g
  • $ 450.00
  • TRC
  • 4-(Benzyloxy)-2-butynoicAcidMethylEster
  • 100mg
  • $ 150.00
  • Medical Isotopes, Inc.
  • 4-(Benzyloxy)-2-butynoicAcidMethylEster
  • 1 g
  • $ 2200.00
Total 1 raw suppliers
Chemical Property of 2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester
Chemical Property:
  • Boiling Point:311.7±25.0 °C(Predicted) 
  • PSA:35.53000 
  • Density:1.125±0.06 g/cm3(Predicted) 
  • LogP:1.37960 
  • Storage Temp.:-20°C Freezer 
  • Solubility.:Chloroform, Methanol 
  • XLogP3:1.9
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:4
  • Exact Mass:204.078644241
  • Heavy Atom Count:15
  • Complexity:253
Purity/Quality:

4-(Benzyloxy)-2-butynoicAcidMethylEster *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC(=O)C#CCOCC1=CC=CC=C1
  • Uses As a reactant used in organic chemistry, 4-(Benzyloxy)-2-butynoic Acid Methyl Ester can be used in the preparation of (+)-linalool oxide, (-)-isocyclocapitelline, and (-)-isochrysotricine.
Technology Process of 2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester

There total 4 articles about 2-Butynoic acid, 4-(phenylmethoxy)-, methyl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
Benzyl propargyl ether; With n-butyllithium; In tetrahydrofuran; at -78 - -20 ℃;
methyl chloroformate; In tetrahydrofuran; at -78 - 20 ℃;
DOI:10.1021/jo0341362
Guidance literature:
Multi-step reaction with 3 steps
1: 1.) oxalyl chloride, DMSO, 2.) triethylamine / 1.) hexane, CH2Cl2, -78 deg C, 10 min, 2.) -78 deg C to room temperature
2: 1.) triphenylphosphine, zinc / 1.) CH2Cl2, room temperature, 12 h, 2.) CH2Cl2, room temperature, 1.5 h
3: 1.) butyllithium / 1.) THF, hexane, -78 deg C, 1 h, 2.) -78 deg C to room temperature
With n-butyllithium; oxalyl dichloride; dimethyl sulfoxide; triethylamine; triphenylphosphine; zinc;
DOI:10.1016/0008-6215(93)80096-W
Guidance literature:
Multi-step reaction with 2 steps
1: 1.) triphenylphosphine, zinc / 1.) CH2Cl2, room temperature, 12 h, 2.) CH2Cl2, room temperature, 1.5 h
2: 1.) butyllithium / 1.) THF, hexane, -78 deg C, 1 h, 2.) -78 deg C to room temperature
With n-butyllithium; triphenylphosphine; zinc;
DOI:10.1016/0008-6215(93)80096-W
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