2h-Dibenzo[b,f]azepin-2-one

Base Information

• Chemical Name: 2h-Dibenzo[b,f]azepin-2-one
• CAS No.: 21186-31-2
• Molecular Formula: C₁₄H₉NO
• Molecular Weight: 207.232
• Hs Code.: 2933990090
• NSC Number: 124435
• UNII: FJN4CQ57JM
• DSSTox Substance ID: DTXSID90298575
• Nikkaji Number: J83.067D
• Wikidata: Q27149644
• Mol file: 21186-31-2.mol

Synonyms:2h-dibenzo[b,f]azepin-2-one;21186-31-2;benzo[b][1]benzazepin-3-one;2H-Dibenz[b,f]azepin-2-one;2-Oxo-2H-dibenzazepine;FJN4CQ57JM;2H-Dibenz(b,f)azepin-2-one;NSC-124435;Benzo(b)(1)benzazepin-3-one;UNII-FJN4CQ57JM;NSC124435;Carbamazepine iminoquinone;Dibenzo[b,f]azepin-2-one;SCHEMBL1365652;CHEBI:80600;DTXSID90298575;CVKDTTCYQAJIAC-UHFFFAOYSA-N;(4aZ,10Z)-2H-dibenzo[b,f]azepin-2-one;CS-0093587;Q27149644;2-azatricyclo[9.4.0.0?,?]pentadeca-1(15),2,4,7,9,11,13-heptaen-6-one

Chemical Property of 2h-Dibenzo[b,f]azepin-2-one

Chemical Property:

• Vapor Pressure: 2.2E-06mmHg at 25°C
• Boiling Point: 393°C at 760 mmHg
• Flash Point: 162.3°C
• PSA: 29.96000
• Density: 1.18g/cm³
• LogP: 2.69980
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 207.068413911
• Heavy Atom Count: 16
• Complexity: 440

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC3=CC(=O)C=CC3=N2

Technology Process of 2h-Dibenzo[b,f]azepin-2-one

There total 3 articles about 2h-Dibenzo[b,f]azepin-2-one 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: 77.0%

dibenzoazepine (256-96-2) → 9-acridincarboxaldehyde (885-23-4) + 2-oxo-2H-dibenzazepine (21186-31-2)

Guidance literature:

With potassium nitrososulfonate; Na₂HPO₂; In acetone; pH=7.22; cooling;

DOI:10.1021/jm030599o

Reference yield: 46.0%

dibenzoazepine (256-96-2) → 2-oxo-2H-dibenzazepine (21186-31-2)

Guidance literature:

With iodopentafluorobenzene bis(trifluoroacetate); In water; acetonitrile; for 1h; Ambient temperature;

DOI:10.1007/BF00810833

Reference yield:

→ 2-oxo-2H-dibenzazepine (21186-31-2)

Guidance literature:

Dibenzazepin, Na2HPO3, Fremys Salz;

upstream raw materials:

dibenzoazepine

Downstream raw materials:

2-Hydroxycarbamazepine

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