8-Chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione

Base Information

• Chemical Name: 8-Chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione
• CAS No.: 195983-60-9
• Molecular Formula: C₉H₇ClN₂O₂
• Molecular Weight: 210.62
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID40444363
• Wikidata: Q82262485
• Mol file: 195983-60-9.mol

Synonyms:8-chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione;195983-60-9;8-chloro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione;8-Chloro-3,4-dihydro-1H-benzo-[e][1,4]diazepine-2,5-dione;Oprea1_301994;SCHEMBL1557756;DTXSID40444363;VHA98360;MFCD02956114;AKOS022172521;AC-9242;AS-37389;CS-0172381;A813828;8-chloranyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione;8-Chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5 -dione;8-Chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione, AldrichCPR

Chemical Property of 8-Chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.58
• Boiling Point: 566.3°Cat760mmHg
• Flash Point: 296.3°C
• PSA: 58.20000
• Density: 1.394g/cm³
• LogP: 1.48870
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 210.0196052
• Heavy Atom Count: 14
• Complexity: 270

Purity/Quality:

97% ^*data from raw suppliers

8-Chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=O)NC2=C(C=CC(=C2)Cl)C(=O)N1

Technology Process of 8-Chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione

There total 1 articles about 8-Chloro-3,4-dihydro-1h-benzo[e][1,4]diazepine-2,5-dione 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:

4-chloroisatoic anhydride (40928-13-0) + glycine ethyl ester hydrochloride (623-33-6) → 8-chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione (195983-60-9)

Guidance literature:

With pyridine; for 7h; Heating;

DOI:10.1021/jm990391w

Reference yield:

8-chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione (195983-60-9) → 8-Chloro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine (107479-55-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 18h; Heating;

DOI:10.1021/jm990391w

upstream raw materials:

4-chloroisatoic anhydride

glycine ethyl ester hydrochloride

Downstream raw materials:

8-Chloro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

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