1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-

Base Information

Chemical Name:1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-
CAS No.:62770-53-0
Molecular Formula:C₁₃H₁₆O₂
Molecular Weight:204.269
Hs Code.:
DSSTox Substance ID:DTXSID60333260

Synonyms:NSC666547;62770-53-0;1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-;DTXSID60333260;HMS1704H02;AKOS000618726;AKOS030484904;SR-01000310404;SR-01000310404-1;8a-allyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione;8a-Allyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione

Suppliers and Price of 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-

Chemical Property:

XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:204.115029749
Heavy Atom Count:15
Complexity:352

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC12CCC(=O)C=C1CCCC2=O

Technology Process of 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)-

There total 1 articles about 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-(2-propenyl)- 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:

: 42738-68-1
2-allylcyclohexane-1,3-dione

: 78-94-4,25038-87-3
methyl vinyl ketone

: 62770-53-0
3,4,8,8a-tetrahydro-8a-allyl-1,6-(2H,7H)-naphthalenedione

: 4-allyl-2(3-oxobutyl)-1,3-cyclohexadione

Guidance literature:: With pyrrolidine; potassium hydroxide; Yield given. Multistep reaction. Yields of byproduct given; 1.) water, methanol, reflux, 75 min, 2.) benzene, reflux;
DOI:10.1080/00397919608003699

Reference yield:

: 62770-53-0,21449-38-7
(S)-8a-allyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione

: C₂₂H₂₇FO₃

Guidance literature:: Multi-step reaction with 6 steps

1: sodium tetrahydroborate; ethanol / 1 h / 0 °C

2: lithium; ammonia; potassium tert-butylate / tetrahydrofuran / 1 h / -78 °C

3: palladium 10% on activated carbon; hydrogen / ethyl acetate / 2 h / 20 °C / 760.05 Torr

4: toluene-4-sulfonic acid / benzene / 16 h / Dean-Stark; Reflux

5: magnesium sulfate; dipyridinium dichromate / dichloromethane / 20 °C

6: / ethanol / 20 °C

With sodium tetrahydroborate; dipyridinium dichromate; ethanol; palladium 10% on activated carbon; potassium tert-butylate; ammonia; hydrogen; lithium; magnesium sulfate; toluene-4-sulfonic acid; In tetrahydrofuran; ethanol; dichloromethane; ethyl acetate; benzene;