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(E)-3-(2-Methyl-6,11-dihydrodibenzo(b,e)thiepin-11-ylidene)propionic acid is a complex chemical compound that features a propionic acid derivative with a thiepin ring and a double bond in the (E)-configuration. This molecule exhibits pharmacological properties and has been investigated for its potential applications in the medical field. The presence of the thiepin ring suggests that it may possess biological activities related to this structural feature, and its intricate structure implies that it may interact with other molecules in unique ways. Further research into its properties and potential applications could uncover its significance in various domains.

112930-60-6

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112930-60-6 Usage

Uses

Used in Pharmaceutical Industry:
(E)-3-(2-Methyl-6,11-dihydrodibenzo(b,e)thiepin-11-ylidene)propionic acid is used as a pharmaceutical compound for its potential therapeutic applications. The presence of the thiepin ring and the complex molecular structure may contribute to its interaction with biological targets, making it a candidate for the development of new drugs.
Used in Research and Development:
In the field of research and development, (E)-3-(2-Methyl-6,11-dihydrodibenzo(b,e)thiepin-11-ylidene)propionic acid serves as a valuable compound for studying its pharmacological properties and potential interactions with other molecules. This can lead to a better understanding of its mechanisms of action and the discovery of new applications in medicine.
Used in Drug Design and Synthesis:
(E)-3-(2-Methyl-6,11-dihydrodibenzo(b,e)thiepin-11-ylidene)propionic acid is used as a key component in drug design and synthesis. Its unique structure and pharmacological properties make it a promising candidate for the development of novel therapeutic agents, particularly in the areas of medicinal chemistry and drug discovery.

Check Digit Verification of cas no

The CAS Registry Mumber 112930-60-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,2,9,3 and 0 respectively; the second part has 2 digits, 6 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 112930-60:
(8*1)+(7*1)+(6*2)+(5*9)+(4*3)+(3*0)+(2*6)+(1*0)=96
96 % 10 = 6
So 112930-60-6 is a valid CAS Registry Number.
InChI:InChI=1/C18H16O2S/c1-12-6-8-17-16(10-12)15(7-9-18(19)20)14-5-3-2-4-13(14)11-21-17/h2-8,10H,9,11H2,1H3,(H,19,20)/b15-7+

112930-60-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid

1.2 Other means of identification

Product number -
Other names -

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

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More Details:112930-60-6 SDS

112930-60-6Relevant academic research and scientific papers

SYNTHESIS OF 3-(6,11-DIHYDRODIBENZOTHIEPIN-11-YLIDENE)-PROPANOIC ACID AND RELATED COMPOUNDS

Polivka, Zdenek,Licha, Irena,Taufmann, Petr,Svatek, Emil,Holubek, Jiri,Protiva, Miroslav

, p. 1566 - 1581 (2007/10/02)

THe alcohol XIa, obtained by reaction of dibenzothiepin-11(6H)-one with vinylmagnesium bromide, was transformed by treatment with hydrogen bromide in acetic acid to the bromo compound XIIa which was converted via the nitrile XIIIa to the title acid VIIIa.The pure (E)-isomer was prepared and correlated via the dimethylamide XVIIIa with (E)-prothiadene (Ia).Similar procedures in the 2-methyl-6,11-dihydrodibenzothiepin and 10,11-dihydrodibenzocycloheptene series afforded the acids VIIIb and IV.The acids VIIIab were oxidized with hydrogen peroxide to the sulfoxides IXab and to the sulfones Xab.The acid IV is the suggested metabolite of the antidepressant amitriptyline (II) and the acids VIIIab-Xab are potential metabolites of the antidepressant prothiadene (Ia) and the antihistamine agent methiadene (Ib).The amides VII and XVIab were prepared from the acids via the acid chlorides.The (Z)-isomer of prothiadene (XXII) was prepared from dibenzothiepin-11(6H)-one by the Wittig reaction.The acids IV, VIIIab and IXab showed some antiinflammatory activity.

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