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2,4-dimethoxy-1-[(1E)-prop-1-en-1-yl]benzene, also known as isosafrole, is an organic compound with the chemical formula C10H12O3. It is a colorless to pale yellow liquid with a strong, sweet odor. Isosafrole is a monoterpene, which is a class of organic compounds derived from isoprene units. It is found in several plants, including sassafras and star anise, and has been used as a flavoring agent and fragrance component. However, due to its potential health risks, including carcinogenic and mutagenic properties, its use in food and beverages has been banned in many countries. The compound is also used as a chemical intermediate in the synthesis of various pharmaceuticals and other organic compounds.

829-39-0

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829-39-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 829-39-0 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,2 and 9 respectively; the second part has 2 digits, 3 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 829-39:
(5*8)+(4*2)+(3*9)+(2*3)+(1*9)=90
90 % 10 = 0
So 829-39-0 is a valid CAS Registry Number.

829-39-0Relevant academic research and scientific papers

Enantioselective Oxy-Heck–Matsuda Arylations: Expeditious Synthesis of Dihydrobenzofuran Systems and Total Synthesis of the Neolignan (?)-Conocarpan

Silva, Allan R.,Polo, Ellen C.,Martins, Nelson C.,Correia, Carlos Roque D.

, p. 346 - 365 (2018/01/26)

This work discloses the first examples of an effective enantioselective oxy-Heck–Matsuda reaction using a variety of styrenic olefins to generate chiral dihydrobenzofurans. The reaction proceeds in moderate to good yields, with high trans diastereoselectivity (up to 20:1) in enantioselectivities up to 90:10 using the N,N-ligand pyrimidine-bisoxazoline (PyriBox). The oxy-Heck–Matsuda reactions were carried out under mild conditions and rather low catalyst loadings. The feasibility and practicality of the process is demonstrated by a concise total synthesis of the neolignan (?)-conocarpan. X-ray diffraction of an advanced brominated intermediate in the route to (?)-conocarpan has allowed the unequivocal assignment of the absolute stereochemistry of the oxy-Heck–Matsuda aryldihydrobenzofuran products. A rationale for the mechanism operating in these enantioselective oxy-Heck–Matsuda reactions is also presented. (Figure presented.).

Synthesis of cyclobutane lignans via an organic single electron oxidant-electron relay system

Riener, Michelle,Nicewicz, David A.

, p. 2625 - 2629 (2013/07/28)

A direct method to synthesize lignan cyclobutanes and analogs via photoinduced electron transfer is presented. A variety of oxygenated alkenes are employed to furnish terminal or substituted cyclobutane adducts with complete regiocontrol, yielding cycload

Oxocarbons and related compounds. 27. Synthesis of dihydrocyclobuta[a]naphthalene-1,2-diones and cyclobuta[a]naphthalene-1,2-diones via annulation of alkoxy-(1-alkenyl)benzenes with 3-chloro-3-cyclobutene-1,2-dione. Scope and limitations

Schmidt, Arthur H.,Kircher, Gunnar,Spring, Mathias,Hendriok, Markus W.,Kuenz, Christian

, p. 564 - 574 (2007/10/03)

The reaction of alkoxy-(1-alkenyl)benzenes with semisquaric chloride (3) has been investigated systematically. 1,2-Dialkoxy- and 1-alkoxy′-2-alkoxy″-4-(1-alkenyl)benzenes (6a-j) and (11a-i) react with 3 to give the 3,4-dihydrocyclobuta[a]naphthalene-1,2-diones(8a-j) and (12a-i). Treatment of the dihydrocyclobuta[a]naphthalene-1,2-diones with 1.2 equiv. bromine effects dehydrogenation and affords cyclobuta[a]naphthalene-1,2-diones(9a-e) and (13b-f). Any efforts to extend this annulation reaction to dimethoxy-(1-alkenyl)benzenes with the methoxy groups in other than the 1,2-positions, e. g. 14a, b, 16a, b have been unsuccessful. The reaction of 1,2,3-trimethoxy-4-(1-propenyl) [and 4-(1-butenyl)]-benzenes (18a) and (18b) with semisquaric chloride (3) leads to the elimination of HCl and CH3OH and gives 5,6-dimethoxy-3-methyl [and 3-ethyl]-cyclobuta[a]naphthalene-1,2-diones (20a) and (20b). The reaction pathway of this novel annulation reaction is discussed.

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