5-(2-Chlorophenyl)-2-furaldehyde

Base Information

• Chemical Name: 5-(2-Chlorophenyl)-2-furaldehyde
• CAS No.: 34035-04-6
• Molecular Formula: C11H7 Cl O2
• Molecular Weight: 206.628
• Hs Code.: 29321900
• European Community (EC) Number: 622-983-0
• DSSTox Substance ID: DTXSID90346121
• Nikkaji Number: J1.681.676K
• Wikidata: Q82119005
• ChEMBL ID: CHEMBL4455950
• Mol file: 34035-04-6.mol

Synonyms:5-(2-Chlorophenyl)-2-furaldehyde;34035-04-6;5-(2-chlorophenyl)furan-2-carbaldehyde;5-(2-Chlorophenyl)furfural;5-(2-Chloro-phenyl)-furan-2-carbaldehyde;MFCD00216585;2-Furancarboxaldehyde, 5-(2-chlorophenyl)-;SCHEMBL1616299;CHEMBL4455950;DTXSID90346121;5-(2-Chlorophenyl)furfural, 95%;STK070473;5-(2-chloro-phenyl)furan-2-aldehyde;5-(2-Chlorophenyl)-2-furaldehyde #;AKOS000113406;SB61112;BB 0222874;CS-0308401;FT-0639151;EN300-11885;6F-027;E74079;A822050;AA-504/06818056;J-516102;Z56860346

Chemical Property of 5-(2-Chlorophenyl)-2-furaldehyde

Chemical Property:

• Vapor Pressure: 0.000138mmHg at 25°C
• Melting Point: 68-72 °C(lit.)
• Refractive Index: 1.595
• Boiling Point: 333.3°C at 760 mmHg
• Flash Point: 155.4°C
• PSA: 30.21000
• Density: 1.282g/cm³
• LogP: 3.41250
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 206.0134572
• Heavy Atom Count: 14
• Complexity: 208

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-(2-chlorophenyl)-2-furaldehyde ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=CC=C(O2)C=O)Cl
• Uses: 5-(2-Chlorophenyl)furfural was used as one of the aldehydes in the synthesis of the uridine-based library.

Technology Process of 5-(2-Chlorophenyl)-2-furaldehyde

There total 12 articles about 5-(2-Chlorophenyl)-2-furaldehyde 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: 83.0%

5-bromo-2-furancarboxaldehyde (1899-24-7) + 2-Chlorobenzeneboronic acid (3900-89-8) → 5-(2-chlorophenyl)furan-2-carbaldehyde (34035-04-6)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In ethanol; toluene; at 120 ℃; for 3h;

DOI:10.1016/j.bmcl.2011.07.107

Reference yield: 70.0%

furfural (98-01-1) + o-chloroaniline (95-51-2) → 5-(2-chlorophenyl)furan-2-carbaldehyde (34035-04-6)

Guidance literature:

o-chloroaniline; With hydrogenchloride; sodium nitrite; In water; at 0 ℃; for 1h;

furfural; With copper dichloride; In water; acetone; at 25 ℃; for 12h;

DOI:10.1016/j.ejmech.2018.03.024

Reference yield: 67.0%

furfural (98-01-1) + 2-chlorobenzenediazonium chloride (89-90-7) → 5-(2-chlorophenyl)furan-2-carbaldehyde (34035-04-6)

Guidance literature:

With copper(l) chloride; In water; at 20 ℃; for 48h;

DOI:10.1016/S0957-4166(03)00286-6

upstream raw materials:

furfural

o-chloroaniline

5-iodofuran-2-carbaldehyde

chlorobenzene

Downstream raw materials:

3-[5-(2-chlorophenyl)-2-furanyl]-3-hydroxypropanoic acid

rac-3-[5-(2-chlorophenyl)furan-2-yl]-3-hydroxypropanenitrile

C₁₄H₁₃ClO₃

1-(5-(2-chlorophenyl)furan-2-yl)ethanol

Refernces

• 1、 Sharghi, Hashem,Mashhadi, Elahe,Aberi, Mahdi,Aboonajmi, Jasem. "Synthesis of novel benzimidazoles and benzothiazoles via furan-2-carboxaldehydes, o-phenylenediamines, and 2-aminothiophenol using Cu(II) Schiff-base@SiO2 as a nanocatalyst". . . Retrieved 2021/06/25.
• 2、 Vallone, Alessandra,D'Alessandro, Sarah,Brogi, Simone,Brindisi, Margherita,Chemi, Giulia,Alfano, Gloria,Lamponi, Stefania,Lee, Soon Goo,Jez, Joseph M.,Koolen, Karin J.M.,Dechering, Koen J.,Saponara, Simona,Fusi, Fabio,Gorelli, Beatrice,Taramelli, Donatella,Parapini, Silvia,Caldelari, Reto,Campiani, Giuseppe,Gemma, Sandra,Butini, Stefania. "Antimalarial agents against both sexual and asexual parasites stages: structure-activity relationships and biological studies of the Malaria Box compound 1-[5-(4-bromo-2-chlorophenyl)furan-2-yl]-N-[(piperidin-4-yl)methyl]methanamine (MMV019918) and analogues". . p. 698 - 718. Retrieved 2018/03/24.