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5-Isoxazoleacetonitrile, 3-phenyl- is a chemical compound with the molecular formula C10H6N2O and a molecular weight of 170.17 g/mol. It is a derivative of isoxazole, a heterocyclic compound containing a five-membered ring with one oxygen and one nitrogen atom. The 3-phenyl substitution refers to the presence of a phenyl group (C6H5) attached to the third carbon of the isoxazole ring. 5-Isoxazoleacetonitrile, 3-phenyl- is known for its potential applications in the synthesis of various pharmaceuticals and agrochemicals, as well as its use as an intermediate in organic chemistry. It is typically synthesized through a multi-step process involving the reaction of phenylglyoxal with hydroxylamine, followed by cyclization and dehydration steps. Due to its reactivity and functional groups, 5-isoxazoleacetonitrile, 3-phenyl- can undergo further chemical transformations, making it a valuable building block in the development of new compounds with specific properties and applications.

129681-59-0

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129681-59-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 129681-59-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,9,6,8 and 1 respectively; the second part has 2 digits, 5 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 129681-59:
(8*1)+(7*2)+(6*9)+(5*6)+(4*8)+(3*1)+(2*5)+(1*9)=160
160 % 10 = 0
So 129681-59-0 is a valid CAS Registry Number.

129681-59-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(3-phenyl-1,2-oxazol-5-yl)acetonitrile

1.2 Other means of identification

Product number -
Other names 5-cyanomethyl-3-phenylisoxazole

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:129681-59-0 SDS

129681-59-0Relevant academic research and scientific papers

Product selectivity of thermal Buchner reaction of methyl 2-(3-arylisoxazol-5-yl)-2-diazoacetates with benzene, naphthalene and mesitylene, and ring-opening/closing reaction of products

Serebryannikova, Anna V.,Galenko, Ekaterina E.,Novikov, Mikhail S.,Khlebnikov, Alexander F.

, (2021/05/04)

Methyl 2-(3-arylisoxazol-5-yl)-2-diazoacetates were synthesized and the product selectivity of their thermal Buchner reaction with benzene, naphthalene and mesitylene was studied. The reaction of the isoxazolyl-substituted diazoacetates with benzene gave

Ramoplanin derivatives possessing antibacterial activity

-

Page/Page column 39; 56, (2010/11/23)

Novel ramoplanin derivatives are disclosed. These ramoplanin derivatives exhibit antibacterial activity. As the compounds of the subject invention exhibit potent activities against gram positive bacteria, they are useful antimicrobial agents. Methods of synthesis and of use of the compounds are also disclosed.

Chemical transformations on 6-aryl-3-cyano4-methylthio-pyran-2(h)-ones: Synthetic and structural studies on novel N-phenylpyrazoles and N-phenylpyrazolylcoumarins

Kumar, Ajay,Malhotra, Sanjay,Vats, Archana,Himanshu,Singh, Sanjay K.,Sharma, Sunil K.,Prasad, Ashok K.,Errington, William,Olsen, Carl E.,Jain, Subhash C.,Parmar, Virinder S.

, p. 360 - 367 (2007/10/03)

Seven 6-aryl-3-cyano-4-methylthiopyran-2(H)ones 1-7 have been prepared and used for the efficient synthesis of twelve 1,3-diaryl-5-cyanomethylpyrazoles 8-19, one 3-cyanomethyl-5-(3,4-methylenedioxyphenyl)pyrazole 22 and one 5-cyanomethyl-3-phenylisoxazole

Synthetic and mass spectral fragmentation studies on trisubstituted 2H-pyran-2-ones and comparative EIMS behaviour of biologically active 3,5-disubstituted pyrazoles and isoxazoles

Parmar, Virinder S.,Jain, Subhash C.,Jha, Amitabh,Kumar, Naresh,Kumar, Ajay,Vats, Archana,Jha, Hriday N.,Mukherjee, Shubhasish,Singh, Sanjay K.,Jennings, Keith R.,Summerfield, Scott G.,Errington, William,Olsen, Carl E.

, p. 872 - 879 (2007/10/03)

Eight 3-cyano-4-thiomethyl-6-aryl-2H-pyran-2-ones 1-8 and three 3-cyano-4-(N,N-dimethy)amino-6-aryl-2H-pyran-2-ones 9-11 have been synthesised and their detailed mass fragmentation pattern alongwith the X-ray crystal structure of a novel pyrone 5 have been studied. In addition, a comparative EIMS behaviour of 3,5-disubstituted pyrazoles 16-23 and isoxazoles 12-15 is reported. The pyrazole derivative 23 has been found to possess strong anti-invasive activity against human breast carcinoma cells.

FORMATION AND REACTIVITY OF HIGHLY STABILIZED CARBANIONS AND ENOLATES BY Pd-CATALYZED ALKYLATION OF HETEROCYCLIC COMPOUNDS

Sakakibara, Tsutomu,Kume, Takashi,Shimohara, Kumiko,Fujishima, Hiroshi,Hara, Shunpei,Shimoda, Toshifumi

, p. 459 - 472 (2007/10/02)

Highly stabilized carbanion and enolate salts, heterocycle-substituted sodiomalononitrile and sodiocyanoacetates, were synthesized via Pd-catalyzed ring-alkylation of bromoheterocyclic compounds and shown to be useful intermediates for the synthesis of va

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