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3-Acetyl-5-chloro-2-hydroxy-6-methylbenzonitrile is a complex organic chemical compound with the molecular formula C10H7ClNO2. It features a benzene ring with a methyl group at the 6th position, a hydroxyl group at the 2nd position, a chloro group at the 5th position, and an acetyl group at the 3rd position. 3-Acetyl-5-chloro-2-hydroxy-6-Methylbenzonitrile is characterized by its nitrile functional group, which is a triple-bonded nitrogen atom. It is a white crystalline solid and is used in the synthesis of various pharmaceuticals and agrochemicals due to its unique structure and reactivity. The compound's properties, such as its melting point, solubility, and stability, are influenced by the presence of these functional groups, making it a versatile building block in organic synthesis.

1312686-22-8

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1312686-22-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 1312686-22-8 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,3,1,2,6,8 and 6 respectively; the second part has 2 digits, 2 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1312686-22:
(9*1)+(8*3)+(7*1)+(6*2)+(5*6)+(4*8)+(3*6)+(2*2)+(1*2)=138
138 % 10 = 8
So 1312686-22-8 is a valid CAS Registry Number.

1312686-22-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-acetyl-5-chloro-2-hydroxy-6-methylbenzonitrile

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:1312686-22-8 SDS

1312686-22-8Relevant academic research and scientific papers

INCB050465 (Parsaclisib), a Novel Next-Generation Inhibitor of Phosphoinositide 3-Kinase Delta (PI3Kδ)

Yue, Eddy W.,Li, Yun-Long,Douty, Brent,He, Chunhong,Mei, Song,Wayland, Brian,Maduskuie, Thomas,Falahatpisheh, Nikoo,Sparks, Richard B.,Polam, Padmaja,Zhu, Wenyu,Glenn, Joseph,Feng, Hao,Zhang, Ke,Li, Yanlong,He, Xin,Katiyar, Kamna,Covington, Maryanne,Feldman, Patricia,Shin, Niu,Wang, Kathy He,Diamond, Sharon,Li, Yu,Koblish, Holly K.,Hall, Leslie,Scherle, Peggy,Yeleswaram, Swamy,Xue, Chu-Biao,Metcalf, Brian,Combs, Andrew P.,Yao, Wenqing

, p. 1554 - 1560 (2019/11/11)

A medicinal chemistry effort focused on identifying a structurally diverse candidate for phosphoinositide 3-kinase delta (PI3Kδ) led to the discovery of clinical candidate INCB050465 (20, parsaclisib). The unique structure of 20 contains a pyrazolopyrimidine hinge-binder in place of a purine motif that is present in other PI3Kδinhibitors, such as idelalisib (1), duvelisib (2), and INCB040093 (3, dezapelisib). Parsaclisib (20) is a potent and highly selective inhibitor of PI3Kδwith drug-like ADME properties that exhibited an excellent in vivo profile as demonstrated through pharmacokinetic studies in rats, dogs, and monkeys and through pharmacodynamic and efficacy studies in a mouse Pfeiffer xenograft model.

BICYCLIC HETEROARYLAMINOALKYL PHENYL DERIVATIVES AS PI3K INHIBITORS

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Paragraph 0333-0334, (2015/12/30)

This application relates to derivatives of Formula I: and pharmaceutically acceptable salts thereof, which are inhibitors of PI3K, and compositions and methods of treatment related thereto.

HETEROCYCLYLAMINES AS PI3K INHIBITORS

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Paragraph 0802, (2013/03/26)

The present invention provides heterocyclylamine derivatives of Formula I: wherein the variables are defined herein, that modulate the activity of phosphoinositide 3-kinases (PI3Ks) and are useful in the treatment of diseases related to the activity of PI3Ks including, for example, inflammatory disorders, immune-based disorders, cancer, and other diseases.

N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS

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, (2012/06/30)

The present invention provides N-(1-(substituted-phenyl)ethyl)-9H-purin-6-amines derivatives that modulate the activity of phosphoinositide 3-kinases (PI3Ks) and are useful in the treatment of diseases related to the activity of PI3Ks including, for examp

SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS

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, (2011/07/07)

The present invention provides fused aryl and heteroaryl derivatives of Formula I that modulate the activity of phosphoinositide 3-kinases (PI3Ks) and are useful in the treatment of diseases related to the activity of PI3Ks including, for example, inflammatory disorders, immune-based disorders, cancer, and other diseases

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