5,6,7,8,9,9-Hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate

Base Information

• Chemical Name: 5,6,7,8,9,9-Hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate
• CAS No.: 74416-02-7
• Molecular Formula: C₁₄H₁₂Cl₆O₂
• Molecular Weight: 424.966
• European Community (EC) Number: 660-485-5
• NSC Number: 122984,122983
• DSSTox Substance ID: DTXSID10298411

Synonyms:74416-02-7;NSC122983;5,6,7,8,9,9-hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate;DTXSID10298411;NSC122984;AKOS024434020;NSC-122983;NSC-122984;5,6,7,8,9,9-HEXACHLORO-1,2,3,4,4A,5,88A-OCTAHYDRO14:58DIMETHANONAPHTH2YL ACETATE

Chemical Property of 5,6,7,8,9,9-Hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate

Chemical Property:

• Vapor Pressure: 8.12E-08mmHg at 25°C
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 423.893896
• Heavy Atom Count: 22
• Complexity: 619

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OC1CC2CC1C3C2C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl

Technology Process of 5,6,7,8,9,9-Hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate

There total 3 articles about 5,6,7,8,9,9-Hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-yl acetate 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:

→ exo-dihydroaldrinol acetate (74416-02-7,92218-68-3,144829-92-5)

Guidance literature:

With sulfuric acid; acetic acid;

DOI:10.1039/jr9610004809

Reference yield:

hexachlorocyclopentadiene (77-47-4) → (+/-)-2t-acetoxy-5,6,7,8,9,9-hexachloro-(4at,8at)-1,2,3,4,4a,5,8,8a-octahydro-1r,4c;5t,8t-dimethano-naphthalene (74416-02-7,92218-68-3,144829-92-5)

Guidance literature:

Reference yield:

→ 1α,2β,3β,1,8,9,10,11,11-Hexachlortetracyclo<6.2.1.13.6.02.7>-dodec-9-en-4α-yl-acetat (74416-02-7,92218-68-3,144829-92-5)

Guidance literature:

Isodrin, H2SO4 (Eg., 0.5h, Kochen), neben anderen Verb.;

DOI:10.1039/jr9610004809

upstream raw materials:

hexachlorocyclopentadiene

Downstream raw materials:

(+/-)-5,6,7,8,9,9-hexachloro-(4at,8at)-1,2,3,4,4a,5,8,8a-octahydro-1r,4c;5t,8t-dimethano-naphthalen-2t-ol

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