Isotadeonal

Base Information

Chemical Name:Isotadeonal
CAS No.:5956-39-8
Deprecated CAS:72581-70-5
Molecular Formula:C₁₅H₂₂O₂
Molecular Weight:234.338
Hs Code.:

Synonyms:Isotadeonal;5956-39-8;(4aS,8aS)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde;CCRIS 1713;1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-, (1S,4aS,8aS)-;1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-, (1S-(1alpha,4aalpha,8abeta))-;1,2-Naphthalenedicarboxaldehyde, 1beta,4,4alpha,5,6,7,8,8a-octahydro-5,5,8abeta-trimethyl-

Suppliers and Price of Isotadeonal

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of Isotadeonal

Chemical Property:

Vapor Pressure:0.000163mmHg at 25°C
Boiling Point:330.7°C at 760 mmHg
Flash Point:124°C
PSA：34.14000
Density:1.094g/cm³
LogP:3.16310
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:234.161979940
Heavy Atom Count:17
Complexity:367

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCCC2(C1CC=C(C2C=O)C=O)C)C
Isomeric SMILES:C[C@]12CCCC([C@@H]1CC=C(C2C=O)C=O)(C)C
Uses Epipolygodial has been shown to be effective against drug resistant cancer cells and other proliferative diseases.

Technology Process of Isotadeonal

There total 16 articles about Isotadeonal 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: 50.0%

: 6754-20-7,72581-70-5
Polygodial

: 5956-39-8,72581-70-5
Isopolygodial

Guidance literature:: With potassium hydroxide; In methanol;
DOI:10.1039/a702743e

Reference yield: 20.0%

: 22567-27-7,34437-62-2,79732-75-5,90581-65-0,94942-39-9,106622-50-8,146276-81-5
((1S,4aR,8aS)-2-Hydroxymethyl-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-methanol

: 5956-39-8,6752-77-8,6754-20-7,33118-34-2,71536-99-7,90581-66-1,90581-67-2,94372-44-8,109838-20-2,109838-21-3,119238-51-6,126188-20-3,72581-70-5
(1S,4aR,8aS)-5,5,8a-Trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1,2-dicarbaldehyde

Guidance literature:: With dimethyl sulfoxide; triethylamine; trifluoroacetic anhydride; at -60 ℃;
DOI:10.1016/S0040-4039(01)80095-2

Reference yield:

: 71557-96-5
dimethyl 3,5,6,7,8,8a-hexahydro-5,5,8a-trimethylnaphthalene-1,2-dicarboxylate

: 5956-39-8,6752-77-8,6754-20-7,33118-34-2,71536-99-7,90581-66-1,90581-67-2,94372-44-8,109838-20-2,109838-21-3,119238-51-6,126188-20-3,72581-70-5
(1S,4aR,8aS)-5,5,8a-Trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1,2-dicarbaldehyde

Guidance literature:: Multi-step reaction with 4 steps

1: 80 percent / 1,5 diazabicyclo<5.4.0>undecene-5 / toluene / 48 h / Heating

2: H₂ / Pd/C / methanol / 760 Torr

3: LiAlH₄

4: 20 percent / trifluoroacetic anhydride, triethylamine, DMSO / -60 °C

With lithium aluminium tetrahydride; hydrogen; dimethyl sulfoxide; triethylamine; trifluoroacetic anhydride; 1,5-Diazabicyclo[5.4.0]undec-5-ene; palladium on activated charcoal; In methanol; toluene;
DOI:10.1016/S0040-4039(01)80095-2