3-BENZYLADENINE

Base Information

• Chemical Name: 3-BENZYLADENINE
• CAS No.: 7280-81-1
• Molecular Formula: C12H11N5
• Molecular Weight: 225.253
• Mol file: 7280-81-1.mol

Synonyms:3-Benzyladenine;NSC 76926;Adenine,3-benzyl- (7CI,8CI);3-benzyl-3H-purin-6-amine;3-Benzyladenine;3-Benzyl-3H-purin-6-amine;3H-purin-6-amine, 3-(phenylmethyl)-;Adenine, 3-benzyl-;

Chemical Property of 3-BENZYLADENINE

Chemical Property:

• Vapor Pressure: 9E-06mmHg at 25°C
• Melting Point: 268-275 °C
• Refractive Index: 1.738
• Boiling Point: 373.4 °C at 760 mmHg
• Flash Point: 179.6 °C
• PSA: 69.62000
• Density: 1.39 g/cm³
• LogP: 2.03800
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO (Slightly), Methanol (Slightly)

Purity/Quality:

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

3-Benzyladenine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-37/38-41
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Technology Process of 3-BENZYLADENINE

There total 15 articles about 3-BENZYLADENINE 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: 98.0%

methyl bromide (74-83-9) + theophylline (58-55-9,75448-53-2) → 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (58-08-2,138455-22-8,95789-13-2) + 3-benzyladenine (7280-81-1)

Guidance literature:

With solution aqueuse d'hydroxide de sodium; tetrabutylammomium bromide; In dichloromethane; 1)20 deg C, 12h 2)40 deg C, 3h;

Reference yield: 94.0%

methyl bromide (74-83-9) + theobromine / (83-67-0) → 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (58-08-2,138455-22-8,95789-13-2) + 3-benzyladenine (7280-81-1)

Guidance literature:

With solution aqueuse d'hydroxide de sodium; tetrabutylammomium bromide; In dichloromethane; 1)20 deg C, 12h 2)40 deg C, 3h;

Reference yield: 90.0%

theophylline (58-55-9,75448-53-2) + methyl iodide (74-88-4) → 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (58-08-2,138455-22-8,95789-13-2) + 3-benzyladenine (7280-81-1)

Guidance literature:

With solution aqueuse d'hydroxide de sodium; tetrabutylammomium bromide; In dichloromethane; 1)20 deg C, 12h 2)40 deg C, 3h;

upstream raw materials:

methyl bromide

theophylline

methyl iodide

theobromine /

Downstream raw materials:

3,7-dibenzyladenine hydrobromide

7-methyladenine

diceto-6,8 purine

3-methyladenine

Refernces

• 1、 Buyens, Dominique M. S.,Mangondo, Paidamwoyo,Cukrowski, Ignacy,Pilcher, Lynne A.. "Solvent-directed Regioselective Benzylation of Adenine: Characterization of N9-benzyladenine and N3-benzyladenine". . p. 2946 - 2950. Retrieved 2017/09/26.
• 2、 Fujii, Tozo,Ogawa, Kazuo,Saito, Tohru,Kobayashi, Keiko,Itaya, Taisuke. "SYNTHESIS OF ADENINE 7-OXIDE FROM ADENINE: UTILIZATION OF A BENZYL GROUP AS A CONTROL SYNTHON AT THE 3-POSITION". . p. 477 - 480. Retrieved 2007/10/02.