2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI)

Base Information

• Chemical Name: 2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI)
• CAS No.: 193968-42-2
• Molecular Formula: C₈H₁₀N₂
• Molecular Weight: 134.181
• Mol file: 193968-42-2.mol

Synonyms:2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI)

Chemical Property of 2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI)

Chemical Property:

• PSA: 25.78000
• LogP: 1.19200

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI)

There total 2 articles about 2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 3,5-dimethyl- (9CI) 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: 20.0%

cyclobutanone (1191-95-3) + acetonitrile (75-05-8,26809-02-9) → 2,4-dimethyl-5,6-dihydrocyclobutapyrimidine (193968-42-2)

Guidance literature:

With trifluoromethylsulfonic anhydride; In dichloromethane; at 42 ℃; for 6h;

DOI:10.1016/S0040-4039(97)01016-2

Reference yield: 20.0%

cyclobutanone (1191-95-3) + acetonitrile (75-05-8,26809-02-9) → 2,4-dimethyl-5,6-dihydrocyclobutapyrimidine (193968-42-2) + N-<1-(2'-oxocyclobutyl)cyclobutyl>acetamide

Guidance literature:

With trifluoromethylsulfonic anhydride; In dichloromethane; Heating;

DOI:10.1021/jo980189l

Reference yield:

2,4-dimethyl-5,6-dihydrocyclobutapyrimidine (193968-42-2) → 2,4-Dimethyl-7-phenyl-5,9-dihydro-pyrrolo[3,4-g]quinazoline-6,8-dione

Guidance literature:

Multi-step reaction with 2 steps

1: 1,2-dichloro-benzene / 180 °C

2: 1,2-dichloro-benzene / 180 °C

In 1,2-dichloro-benzene;

DOI:10.1016/S0040-4039(97)01016-2

upstream raw materials:

cyclobutanone

acetonitrile