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1,4-Methano-1H-3-benzazepine,2,3,4,5-tetrahydro-8-methoxy-1,3-dimethyl-,(1S,4R)-(9CI) is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

791780-36-4

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791780-36-4 Usage

Explanation

The compound's full name, which describes its structure and stereochemistry.

Explanation

The chemical formula representing the number of carbon (C), hydrogen (H), nitrogen (N), and oxygen (O) atoms in the molecule.

Explanation

The mass of one mole of the compound, calculated by adding the atomic weights of all the atoms in the molecular formula.

Explanation

The specific arrangement of atoms in the molecule, indicating the spatial orientation of the chiral centers at positions 1 and 4.

Explanation

The compound has a 1,4-methano-1H-3-benzazepine core, which is a fused ring system consisting of a benzene ring and a partially saturated azepine ring.

Explanation

The compound may be used in the development of new drugs due to its complex structure and potential biological activity. Further research is needed to explore its full potential.

Explanation

The compound's biological activity is not yet fully understood, and more studies are needed to determine its potential effects on living organisms.

Explanation

The compound has a complex structure with multiple functional groups and stereochemistry, making it a challenging target for synthesis and study.

Molecular Weight

271.396 g/mol

Stereochemistry

(1S,4R)-conformation

2,3,4,5-Tetrahydro

Indicates the presence of four hydrogen atoms in the molecule, which are part of the tetrahydro ring system.

8-Methoxy

A methoxy group (-OCH3) is attached to the 8th position of the molecule.

1,3-Dimethyl

Two methyl groups (-CH3) are present at the 1st and 3rd positions of the molecule.

Potential Applications

Research and Development in Pharmaceuticals

Biological Activity

Unknown (requires further research)

Complexity

Complex Organic Compound

Check Digit Verification of cas no

The CAS Registry Mumber 791780-36-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 7,9,1,7,8 and 0 respectively; the second part has 2 digits, 3 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 791780-36:
(8*7)+(7*9)+(6*1)+(5*7)+(4*8)+(3*0)+(2*3)+(1*6)=204
204 % 10 = 4
So 791780-36-4 is a valid CAS Registry Number.

791780-36-4Downstream Products

791780-36-4Relevant academic research and scientific papers

Concise Total Synthesis of (+)-Aphanorphine

Wang, Cheng,Guan, Yukun

supporting information, p. 913 - 916 (2021/04/19)

A concise total synthesis of (+)-aphanorphine is described. The key features of the strategy include a Pd-catalyzed intermolecular trimethylenemethane [3+2]-cycloaddition to form ring C and a Co-catalyzed radical cyclization through a hydrogen-atom transf

An enantioselective approach to (-)-aphanorphine featuring a stereoselective oxidative amidation

Pansare, Sunil V.,Kulkarni, Kaivalya G.

, p. 19127 - 19134 (2013/10/22)

A formal enantioselective synthesis of (-)-aphanorphine (91% ee), that culminates with the preparation of (+)-O-methyl aphanorphine, was achieved. The methodology involves the diastereoselective synthesis of a key 3,5-disubstituted pyrrolidinone intermediate by the intramolecular oxidative amidation of a suitably functionalized α-hydroxy pentenoic acid derivative. A late-stage N-formyl protection, which functions as a latent N-methyl group, is utilized as a simple alternative to a protecting group switch and subsequent N-methylation strategy implemented in all other syntheses of aphanorphine related to the present approach. The Royal Society of Chemistry 2013.

Concise route to (-)- and (+)-aphanorphine

Medjahdi, Mohamed,Gonzalez-Gomez, Jose C.,Foubelo, Francisco,Yus, Miguel

supporting information; experimental part, p. 2230 - 2234 (2011/06/22)

This paper presents an application of two recently developed methodologies to the synthesis of naturally occurring (-)-aphanorphine. The first method involves an indium-mediated stereoselective α-aminoallylation of aldehydes to prepare enantioenriched homoallylic amine derivatives. The second is the epoxidation and regioselective opening of the epoxide to afford 2-substituted 3-pyrrolidinols. The synthesis was completed by using a reported Friedel-Crafts alkylation and conventional functional-group manipulation. According to the same route, the O-methyl derivative of unnatural (+)-aphanorphine was prepared from (S)-2-methylpropane-2-sulfinamide. A straightforward synthesis of the marine alkaloid (-)-aphanorphine was accomplished in 9 steps from commercially available starting materials. Indium-mediated stereoselective α-aminoallylation of an aldehyde, pyrrolidin-3-ol formation byintramolecular nucleophilic opening of an epoxide, and intramolecular Friedel-Crafts alkylation are the key steps in this synthesis. Through this methodology, natural (-)-aphanorphine and its enantiomer are affordable. Copyright

Enantioconvergent synthesis of (+)-aphanorphine via asymmetric pd-catalyzed alkene carboamination

Mai, Duy N.,Rosen, Brandon R.,Wolfe, John P.

supporting information; experimental part, p. 2932 - 2935 (2011/07/30)

A concise asymmetric synthesis of (+)-aphanorphine has been achieved via a new enantioconvergent strategy. A racemic γ-aminoalkene derivative is transformed into a 1:1 mixture of enantiomerically enriched diastereomers using an asymmetric Pd-catalyzed car

An effective route to (-)-aphanorphine using D-tyrosine as a chiral building block

Li, Min,Zhou, Peijie,Roth, Hans F.

, p. 55 - 60 (2007/12/31)

A stereoselective approach toward a naturally occurring alkaloid, (-)-aphanorphine, has been achieved via a series of reactions from Boc-D-tyrosine. Georg Thieme Verlag Stuttgart.

Further studies on a samarium diiodide-promoted reductive carbon-nitrogen bond cleavage rection: Synthesis of (+)-aphanorphine

Katoh, Miho,Inoue, Hiroshi,Honda, Toshio

, p. 497 - 516 (2008/03/12)

Samarium diiodide-promoted carbon-nitrogen bond cleavage reaction was applied to the 1,2,3,4-tetrahydroisoquinoline derivatives bearing an ester group at the 1- or 3-position to give the corresponding benzazepinones. Synthesis of (+)-aphanorphine was esta

Cyclic sulfamidates as versatile lactam precursors. An evaluation of synthetic strategies towards (-)-aphanorphine

Bower, John F.,Szeto, Peter,Gallagher, Timothy

, p. 143 - 150 (2008/03/28)

A full account of studies which led to the efficient asymmetric synthesis of (-)-aphanorphine 1 is reported. Two routes to the key cyclic sulfamidate intermediate 5 are described, the first was based on a chiral auxiliary approach and the second utilised

Formal syntheses of (-)- and (+)-aphanorphine from (2S,4R)-4-hydroxyproline

Ma, Zhiqiang,Hu, Hanwei,Xiong, Wanting,Zhai, Hongbin

, p. 7523 - 7531 (2008/02/08)

We describe the efficient formal syntheses of both natural (-)-aphanorphine and unnatural (+)-aphanorphine from the same commercially available amino acid, (2S,4R)-4-hydroxyproline. The tricyclic framework was constructed by intramolecular Friedel-Crafts

A concise formal synthesis of unnatural (+)-aphanorphine from (2S,4R)-4-hydroxyproline

Ma, Zhiqiang,Zhai, Hongbin

, p. 161 - 163 (2008/03/13)

(-)-Aphanorphine methyl ether was synthesized in ten steps from commercially available (2S,4R)-4-hydroxyproline, featuring the C-2 configuration inversion of an intermediate amide and intramolecular Friedel-Crafts reaction. The present work constitutes a

Enantioselective synthesis of (+)-aphanorphine by means of samarium diiodide promoted reductive carbon-nitrogen bond-cleavage reaction

Katoh, Miho,Inoue, Hiroshi,Suzuki, Atsuko,Honda, Toshio

, p. 2820 - 2822 (2007/10/03)

An enantioselective synthesis of (+)-aphanorphine has been achieved by application of a samarium diiodide promoted reductive carbon-nitrogen bond-cleavage reaction to a 1-methoxy-carbonyl-1,2,3,4-tetrahydroisoquinoline providing a benzazepinone derivative

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