12-Chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-one

Base Information

• Chemical Name: 12-Chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-one
• CAS No.: 2198-01-8
• Molecular Formula: C₁₆H₁₁ClO
• Molecular Weight: 254.716
• NSC Number: 123006
• DSSTox Substance ID: DTXSID10944567
• Mol file: 2198-01-8.mol

Synonyms:2198-01-8;NSC123006;12-chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-one;DTXSID10944567;NSC-123006

Chemical Property of 12-Chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-one

Chemical Property:

• Vapor Pressure: 6.87E-07mmHg at 25°C
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 254.0498427
• Heavy Atom Count: 18
• Complexity: 366

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C3C(C(C2=C1)C4=CC=CC=C4C3=O)Cl

Technology Process of 12-Chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-one

There total 5 articles about 12-Chloro-5,10-dihydro-11h-5,10-methanodibenzo[a,d][7]annulen-11-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:

8-syn-Chlor-2-exo-hydroxy-dibenzobicyclo<3.2.1>octadien (65556-45-8) → anti-8-chlorodibenzobicyclo <3.2.1> octa-3,6-dien-2-one (2198-01-8,2198-02-9)

Guidance literature:

With potassium permanganate; In tert-butyl alcohol;

DOI:10.1021/jo01040a055

Reference yield:

9,10-dihydro-9,10-etheno-anthracene (2734-13-6) → anti-8-chlorodibenzobicyclo <3.2.1> octa-3,6-dien-2-one (2198-01-8,2198-02-9)

Guidance literature:

Multi-step reaction with 3 steps

1: tBuOCl

2: LiAlH₄

3: aq. KMnO₄ / 2-methyl-propan-2-ol

With potassium permanganate; lithium aluminium tetrahydride; tert-butylhypochlorite; In tert-butyl alcohol;

DOI:10.1021/jo01040a055

Reference yield:

syn-8-Chlor-dibenzo-bicyclo<3.2.1>octadien-exo-2-yl-acetat → anti-8-chlorodibenzobicyclo <3.2.1> octa-3,6-dien-2-one (2198-01-8,2198-02-9)

Guidance literature:

Multi-step reaction with 2 steps

1: LiAlH₄

2: aq. KMnO₄ / 2-methyl-propan-2-ol

With potassium permanganate; lithium aluminium tetrahydride; In tert-butyl alcohol;

DOI:10.1021/jo01040a055

upstream raw materials:

C₁₇H₁₃Cl

acetic acid

1-methoxy-trans-7,8-dichloro-2,3,5,6-dibenzobicyclo<2.2.2>octa-2,5-diene

8-syn-Chlor-2-exo-hydroxy-dibenzobicyclo<3.2.1>octadien