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trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4

Base Information
  • Chemical Name:trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4
  • CAS No.:130208-38-7
  • Molecular Formula:C10H6 D4 O
  • Molecular Weight:150.21
  • Hs Code.:
  • European Community (EC) Number:634-165-0
  • DSSTox Substance ID:DTXSID00584113
  • Mol file:130208-38-7.mol
trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4

Synonyms:trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4;130208-38-7;(E)-1,1,1,3-tetradeuterio-4-phenylbut-3-en-2-one;SCHEMBL1332552;DTXSID00584113;J-005761;(3E)-4-Phenyl(1,1,1,3-~2~H_4_)but-3-en-2-one;trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4, 97 atom % D

Suppliers and Price of trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4
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
  • American Custom Chemicals Corporation
  • TRANS-4-PHENYL-3-BUTEN-2-ONE-1,1,1,3-D4 95.00%
  • 1G
  • $ 853.17
  • American Custom Chemicals Corporation
  • TRANS-4-PHENYL-3-BUTEN-2-ONE-1,1,1,3-D4 95.00%
  • 250MG
  • $ 540.00
Total 2 raw suppliers
Chemical Property of trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4
Chemical Property:
  • Vapor Pressure:0.012mmHg at 25°C 
  • Melting Point:39-42 °C(lit.)
     
  • Refractive Index:1.563 
  • Boiling Point:260-262 °C(lit.)
     
  • Flash Point:150 °F  
  • PSA:17.07000 
  • Density:1.042g/cm3 
  • LogP:2.28880 
  • XLogP3:2.1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Rotatable Bond Count:2
  • Exact Mass:150.098271922
  • Heavy Atom Count:11
  • Complexity:152
Purity/Quality:

97% *data from raw suppliers

TRANS-4-PHENYL-3-BUTEN-2-ONE-1,1,1,3-D4 95.00% *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes:F,Xn 
  • Statements: 11-36/37/38-42/43 
  • Safety Statements: 16-26-36 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC(=O)C=CC1=CC=CC=C1
  • Isomeric SMILES:[2H]/C(=C\C1=CC=CC=C1)/C(=O)C([2H])([2H])[2H]
Technology Process of trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4

There total 2 articles about trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4 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:
Benzaldehyd, d(6)-Aceton, NaOD, D2O;
DOI:10.1002/oms.1210130412
Guidance literature:
With iron(II) triflate; 5,5'-dimethyl-2,2'-bipyridine; In benzene; at 120 ℃; for 12h;
DOI:10.1021/acs.orglett.8b01073
upstream raw materials:

[(2)H6]acetone

benzaldehyde

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