Furan-d4

Base Information

• Chemical Name: Furan-d4
• CAS No.: 6142-90-1
• Molecular Formula: C₄H₄O
• Molecular Weight: 72.0434
• European Community (EC) Number: 664-244-5
• DSSTox Substance ID: DTXSID20369904
• Nikkaji Number: J704.763K
• Wikidata: Q82157183
• Mol file: 6142-90-1.mol

Synonyms:Furan-d4;6142-90-1;2,3,4,5-tetradeuteriofuran;Furan D4;Furan-d4, stab.;(?H?)furan;DTXSID20369904;MFCD00075149;AKOS015913427;CS-T-55133;Furan D4 1000 microg/mL in Methanol;Furan D4 100 microg/mL in Acetonitrile;A833220;Furan-d4, >=98 atom % D, >=99% (CP), contains 0.025 wt. % BHT as stabilizer

Chemical Property of Furan-d4

Chemical Property:

• Appearance/Colour: colorless to light yellow liqui
• Vapor Pressure: 9.63 psi ( 20 °C)
• Refractive Index: n20/D 1.4202(lit.)
• Boiling Point: 31.4 °C at 760 mmHg
• Flash Point: −32 °F
• PSA: 13.14000
• Density: 0.998 g/cm³
• LogP: 1.27960
• Storage Temp.: 0-6°C
• Solubility.: Chloroform (Sparingly), DMSO (Slightly), Methanol (Sparingly)
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 72.051321731
• Heavy Atom Count: 5
• Complexity: 22.8

Purity/Quality:

99% ^*data from raw suppliers

Furan-d4 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F+,T
• Hazard Codes: F+,T
• Statements: 45-12-19-20/22-38-48/22-52/53-68
• Safety Statements: 53-45-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC=C1
• Isomeric SMILES: [2H]C1=C(OC(=C1[2H])[2H])[2H]
• Uses: Furan-d4, a five-membered heterocyclic aromatic ring, is used as a building block for the preparation of many heterocyclic compounds. The labelled analogue of Furan, a five-membered heterocyclic aromatic ring. Furan is used as a building block for the preparation of many heterocyclic compounds.

Technology Process of Furan-d4

There total 2 articles about Furan-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:

Reference yield:

furan (110-00-9) → <(2)H4>Furan (6142-90-1)

Guidance literature:

With [IrH₂(bis(2-(diisopropylphosphino)-4-methylphenyl)amide)]; water-d2; In Cyclohexane-d12; at 80 ℃; for 72h;

DOI:10.1021/om201049p

Reference yield:

→ <(2)H4>Furan (6142-90-1)

Guidance literature:

3,4,5-Trideuteriofuran-2-carbonsaeure, HgCl2/DCl;

Reference yield:

<(2)H4>Furan (6142-90-1) + (2,4-bis(2,6-diisopropylphenylimino)pentan-3-ide-.kappa2N,N')aluminum(I) (325465-25-6) → C33H40(2)H4AlN2O

Guidance literature:

With palladium⁽⁰⁾bis(tricyclohexylphosphine); In cyclohexane; at 29.84 ℃; Kinetics;

DOI:10.1039/d0sc01918f

upstream raw materials:

furan

Refernces

• 1、 Iluc, Vlad M.,Fedorov, Alexey,Grubbs, Robert H.. "H/D exchange processes catalyzed by an iridium-pincer complex". scheme or table. p. 39 - 41. Retrieved 2012/04/10.