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1-Cyano-1-cyclopropanecarboxylic acid, also known as 1-Cyanocyclopropanecarboxylic acid, is a substituted cyclopropane that serves as an intermediate in chemical reactions. It is formed during the homoconjugate addition of nucleophiles to cyclopropane-1,1-dicarboxylate derivatives.

6914-79-0

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6914-79-0 Usage

Uses

Used in Pharmaceutical Industry:
1-Cyano-1-cyclopropanecarboxylic acid is used as a key intermediate in the synthesis of amidine-based nanomolar sphingosine kinase 1 (SphK1) subtype-selective inhibitors. These inhibitors are valuable for the development of potential therapeutic agents targeting various diseases, as SphK1 plays a crucial role in cellular processes and has been implicated in the pathophysiology of several disorders.

Check Digit Verification of cas no

The CAS Registry Mumber 6914-79-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,9,1 and 4 respectively; the second part has 2 digits, 7 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 6914-79:
(6*6)+(5*9)+(4*1)+(3*4)+(2*7)+(1*9)=120
120 % 10 = 0
So 6914-79-0 is a valid CAS Registry Number.
InChI:InChI=1/C5H5NO2/c6-3-5(1-2-5)4(7)8/h1-2H2,(H,7,8)/p-1

6914-79-0 Well-known Company Product Price

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  • Alfa Aesar

  • (H27730)  1-Cyano-1-cyclopropanecarboxylic acid, 97%   

  • 6914-79-0

  • 1g

  • 362.0CNY

  • Detail
  • Alfa Aesar

  • (H27730)  1-Cyano-1-cyclopropanecarboxylic acid, 97%   

  • 6914-79-0

  • 5g

  • 1199.0CNY

  • Detail

6914-79-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-Cyano-1-cyclopropanecarboxylic acid

1.2 Other means of identification

Product number -
Other names 1-cyanocyclopropane-1-carboxylic acid

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

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:6914-79-0 SDS

6914-79-0Relevant academic research and scientific papers

BTK Inhibitors and uses thereof

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Paragraph 1771; 1780-1782, (2020/05/02)

The invention discloses a bruton's tyrosine kinase (BTK) inhibitor and use thereof. Specifically, the invention provides heteroaromatic compounds or stereoisomers, geometrical isomers, tautomers, racemates, nitrogen oxides, hydrates, solvates, metabolites and pharmaceutically acceptable salts or prodrugs thereof, and pharmaceutical compositions containing the heteroaromatic compounds; the invention also discloses use of the heteroaromatic compounds or the pharmaceutical compositions containing the heteroaromatic compounds in preparation of medicines; the medicines can be used for treating autoimmune diseases, inflammatory diseases or proliferative diseases.

Synthesis of 2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazoles via the cyclopropyliminium rearrangement of substituted 2-cyclopropylbenzimidazoles

Salikov, Rinat F.,Platonov, Dmitry N.,Frumkin, Aleksandr E.,Lipilin, Dmitry L.,Tomilov, Yury V.

supporting information, p. 3495 - 3505 (2013/04/23)

2-Cyclopropylbenzimidazole derivatives with various substituents in the small ring undergo cyclopropyliminium rearrangement into 2,3- dihydropyrrolobenzimidazoles substituted at positions 1, 2 or 3. The substrates containing a functional group in position 1 of the cyclopropane ring form products substituted at position 3. Substituents at position 2 in most cases lead to the formation of a mixture of isomers. The reaction can be directed to yield one of the isomers predominantly by varying the solvent polarity.

Synthesis, crystal structure and biological activity of 1-cyano-N-phenylcyclopropanecarboxamide

Xue, Yong-Lai,Liu, Xing-Hai,Zhang, Yong-Gang

experimental part, p. 1571 - 1574 (2012/09/07)

A cyclopropane derivative, 1-cyano-N-phenylcyclopropanecarboxamide (C 11H10N2O) was synthesized and its structure was studied by X-ray diffraction, FTIR, 1H NMR spectrum and MS. The crystals are monoclinic, space group Pbc

Synthesis, crystal structure and biological activity of 1-Cyano-N-(2,4-dichlorophenyl)cyclopropanecarboxamide

Xue, Yong-Lai,Zhang, Yong-Gang,Liu, Xing-Hai

experimental part, p. 5087 - 5089 (2012/10/08)

A cyclopropane derivative, 1-cyano-N-(2,4-dichlorophenyl) cyclopropanecarboxamide (C11H8N2OCl2) was synthesized and its structure was studied by X-ray diffraction, FTIR, 1H NMR, MS and elemental analysis. The crystals are monoclinic, space group C2 with a

Synthesis, crystal structure and biological activity of 1-Cyano-N-(4-bromophenyl)cyclopropanecarboxamide

Xue, Yong-Lai,Zhang, Yong-Gang,Liu, Xing-Hai

experimental part, p. 3016 - 3018 (2012/08/29)

A cyclopropane derivative, 1-cyano-N-(4-bromophenyl)cyclopropanecarboxamide (C11H9N2OBr) was synthesized and its structure was studied by X-ray diffraction, FTIR, 1H NMR spectrum and MS. The crystal is triclinic, space group P-1 with α = 8.902(4), β = 10.

Synthesis, bioactivity, theoretical and molecular docking study of 1-cyano-N-substituted-cyclopropanecarboxamide as ketol-acid reductoisomerase inhibitor

Liu, Xing-Hai,Chen, Pei-Quan,Wang, Bao-Lei,Li, Yong-Hong,Wang, Su-Hua,Li, Zheng-Ming

, p. 3784 - 3788 (2008/02/08)

Ketol-acid reductoisomerase (KARI; EC 1.1.1.86) catalyzes the second common step in branched-chain amino acid biosynthesis. The catalyzed process consists of two stages, the first of which is an alkyl migration from one carbon atom to its neighbouring ato

Reaction of cyclopropane carboxylic acid derivatives with sulphur tetrafluoride - An example of a diastereoselective ring opening

Hell,Finta,Dmowski,Faigl,Pustovit,Toke,Harmat

, p. 297 - 301 (2007/10/03)

Cyclopropane carboxylic acid derivatives can be converted into trifluoromethyl group-containing compounds using SF4. In the case of a bicyclic cyclopropane carboxylic acid lactone, similar treatment with sulphur tetrafluoride resulted in the cyclopropane ring opening in a diastereoselective manner.

Preparation and Cleavage of Some Cyclopropane Derivatives

Podder, Ranjan Kumar,Sarkar, Ranjit Kumar,Ray, Suvas C.

, p. 530 - 536 (2007/10/02)

Alkylation of active methylene compounds with 1,2-dibromoethane using anhyd.K2CO3/DMF at room temperature gives cyclopropane derivatives which undergo selective transformation by simple methods.Cyclopropanes, obtained by the condensation of α-diazoacetophenones with olefins, are cleaved to trisubstituted olefins with Grignard reagent.Hydration of the products has also been studied.

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