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The chemical compound "1H-Pyrrole-2-carboxylic acid, 5-[[5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]methyl]-3,4-dimethyl-, phenylmethyl ester" is a complex organic molecule with a molecular formula of C26H29NO4. It features a pyrrole-2-carboxylic acid core, with a 3,4-dimethyl substitution on the pyrrole ring. The molecule also contains a phenylmethyl ester group, which is an aromatic ester derived from benzene and methanol. Additionally, it has a 5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]methyl substituent, which adds to the complexity of the structure. 1H-Pyrrole-2-carboxylic acid, 5-[[5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]methyl]- 3,4-dimethyl-, phenylmethyl ester is characterized by its unique arrangement of functional groups and may have potential applications in various fields, such as pharmaceuticals or materials science, due to its specific chemical properties.

86568-88-9

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86568-88-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 86568-88-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,6,5,6 and 8 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 86568-88:
(7*8)+(6*6)+(5*5)+(4*6)+(3*8)+(2*8)+(1*8)=189
189 % 10 = 9
So 86568-88-9 is a valid CAS Registry Number.

86568-88-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-[(benzyloxy)carbonyl]-5'-[(tert-butyloxy)carbonyl]-3,3',4,4'-tetramethyl-2,2'-dipyrromethane

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:86568-88-9 SDS

86568-88-9Relevant academic research and scientific papers

Metal-catalyzed oxidative cyclizations of a,c-biladiene salts bearing 1- and/or 19-arylmethyl substituents: Macrocyclic products and their chemistry

Lin, Jack J.,Gerzevske, Kevin R.,Liddell, Paul A.,Senge, Mathias O.,Olmstead, Marilyn M.,Khoury, Richard G.,Weeth, Brent E.,Tsao, Stephanie A.,Smith, Kevin M.

, p. 4266 - 4276 (2007/10/03)

Several 1-mono- and 1,19-bis(p-arylmethyl)-a,c-biladiene salts were prepared and subjected to either copper(II)- or chromium(III)-assisted oxidative cyclization to yield numerous products in which the 1- or 19- substituent is adapted, eliminated, or rearranged to other points on the tetrapyrrole. For example, cyclization using copper(II) acetate of 19- ((ethoxycarbonyl)methyl)-2,3,7,8,12,13,17,-18-octamethyl-19-(p-tolylmethyl)- a,c-biladiene dihydrobromide (25) yielded the copper(II) 20- ((ethoxycarbonyl)methyl)-1-(p-tolylmethyl)-2,3,7,8,12,13,17,18-octamethyl- 1,20-dihydroporphyrin (42), copper(II) 20-(ethoxycarbonyl)-3-methylidene- 2,3,7,8,12,13,17,18-octamethyl-2-(p-tolylmethyl)-chlorin (44), copper(II) 20- (ethoxycarbonyl)-2-methylidene-2,3,7,8,12,13,17,18-octamethyl-3-(p- tolylmethyl)chlorin (45), and three porphyrins: copper(II) 20- (ethoxycarbonyl)-2,3,7,8,12,13,17,18-octamethylporphyrin (3), copper(II) 2,3,7,8,12,13,17,18-octamethyl-20-p-tolylporphyrin (50), and copper(II) 20- (ethoxycarbonyl)-2,3,7,8,12,13,17,18-octamethyl-5-(p-tolylmethyl)porphyrin (47). Formation of porphyrin 47 and the intermediate chlorins 44 and 45 suggests the stepwise migration of the arylmethyl group from the 1-position in compound. 42. The isolation of products from cyclization reactions of various 1,19-arylmethyl-substituted a,c-biladiene salts provides further insight into the mechanisms of metal-assisted oxidative cyclization of a,c- biladiene salts to give cyclic tetrapyrroles. Macrocyclizations of a,c- biladienes such as 25 using chromium(III) afford good yields of the metal- free 1-substituted compounds such as 43.

Novel Macrocycles from Metal-Catalyzed Oxidative Cyclizations of a,c-Biladiene Salts

Liddell, Paul A.,Gerzevske, Kein R.,Lin, Jack J.,Olmstead, Marilyn M.,Smith, Kevin M.

, p. 6681 - 6691 (2007/10/02)

From the metal-promoted oxidative cyclization of several 1,19-disubstituted a,c-biladiene dihydrobromide salts, a number of novel macrocycles were prepared.For example, the cyclization of 1,19-bis(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-a,c-biladiene dihydrobromide salt (10) with copper(II) acetate afforded copper(II) 20-((methoxycarbonyl)methyl)-1-(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-1,2a0-dihydroporphyrin (13) (39percent yield), which, upon demetalation, yielded the metal-free 20-((methoxycarbonyl)methyl)-1-(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-1,20-dihydroporphyrin (14) (48percent yield).With the substrate 19-((ethoxycarbonyl)methyl)-1-(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-a,c-biladiene dihydrobromide (15), the metal-catalyzed cyclization process produced copper(II) 20-(ethoxycarbonyl)-1-(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-1,20-dihydroporphyrin (18) (27percent yield) and copper(II) 20-(ethoxycarbonyl)-2-(2-(methoxycarbonyl)ethyl)-2,7,8,12,13,17,18-heptamethyl-3-methylidene-2,3-dihydroporphyrin (23) (19percent yield).Upon demetalation of the copper dihydroporphyrin 18, 20'-(ethoxycarbonyl)-20-(2-(methoxycarbonyl)ethyl)-2,3,7,8,12,13,17,18-octamethyl-20'-homoporphyrin (28) (16.5percent yield) was isolated; demetalation of copper(II) 20-(ethoxycarbonyl)-2-(2-(methoxycarbonyl)ethyl)-2,7,8,12,13,17,18-heptamethyl-3-methylidene-2,3-dihydroporphyrin (23) yielded the free base 20-(ethoxycarbonyl)-2-(2-(methoxycarbonyl)ethyl)-2,7,8,12,13,17,18-heptamethyl-3-methylidene-2,3-dihydroporphyrin (25) (24percent yield).Using chromium(III) hydroxy acetate as the oxidant (in place of copper(II)), 1,2,3,7,8,12,13,17,18-nonamethyl-1,20-dihydroprphyrin (5) (55-62percent) was obtained from the 1,2,3,7,8,12,13,17,18,19-decamethyl-a,c-biladiene salt 3.Mechanisms of macrocycle formation from a,c-biladiene salts, promoted by either copper(II) or chromium(III), appear to proceed via pathways closely resembling the electrochemical cyclization reaction of 1,19-dimethyl-a,c-biladiene salts.

Sapphyrins: Novel Aromatic Pentapyrrolic Macrocycles

Bauer, Victor J.,Clive, Derrick L.J.,Dolphin, David,Paine, John B.,Harris, Francis L.,et al.

, p. 6429 - 6436 (2007/10/02)

Sapphyrins are pentapyrrolic macrocycles containing one direct link and four bridging methine groups between the five pyrrolic subunits.The syntheses of decamethylsapphyrin, other peripherally alkylated derivatives, and metal complexes are described.The p

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