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Benzyl cyanoformate, with the chemical formula C9H9NO2, is a colorless to pale yellow liquid chemical compound. It serves as a versatile intermediate in organic synthesis, particularly for the production of pharmaceuticals, agrochemicals, and other fine chemicals. Its ability to undergo esterification, amidation, and cyclization reactions makes it a valuable reagent in the formation of complex organic compounds. Additionally, benzyl cyanoformate is recognized for its potential as a building block in the synthesis of pharmaceutical compounds. However, it is a hazardous substance that requires proper safety precautions due to its toxicity and potential to cause irritation to the eyes and respiratory system.

5532-86-5

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5532-86-5 Usage

Uses

Used in Pharmaceutical Industry:
Benzyl cyanoformate is used as a key intermediate in the synthesis of various pharmaceutical compounds. Its versatility in undergoing different chemical reactions allows for the creation of complex organic molecules that are essential in developing new drugs and improving existing ones.
Used in Agrochemical Industry:
In the agrochemical sector, benzyl cyanoformate is utilized as an intermediate for the production of various agrochemicals. Its reactivity in chemical reactions contributes to the development of effective and innovative products for agricultural applications.
Used in Fine Chemicals Industry:
Benzyl cyanoformate is employed as a versatile reagent in the synthesis of fine chemicals. Its ability to participate in esterification, amidation, and cyclization reactions makes it an indispensable component in the production of specialty chemicals with specific applications in various industries.
Used in Research and Development:
Benzyl cyanoformate is used as a building block in the research and development of new chemical compounds. Its potential for various chemical reactions makes it a valuable tool for scientists and researchers in exploring novel synthetic pathways and creating innovative products.

Check Digit Verification of cas no

The CAS Registry Mumber 5532-86-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,5,3 and 2 respectively; the second part has 2 digits, 8 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 5532-86:
(6*5)+(5*5)+(4*3)+(3*2)+(2*8)+(1*6)=95
95 % 10 = 5
So 5532-86-5 is a valid CAS Registry Number.
InChI:InChI=1/C9H7NO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,7H2

5532-86-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name BENZYL CYANOFORMATE

1.2 Other means of identification

Product number -
Other names (phenylmethyl) cyanomethanoate

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:5532-86-5 SDS

5532-86-5Relevant academic research and scientific papers

An expedient synthesis of cyanoformates via DAST-mediated C–C bond cleavage of α-oximino-β-ketoesters

Kim, Danhee,Lim, Hee Nam

supporting information, (2021/05/10)

A new protocol to synthesize cyanoformates was developed using simple β-ketoesters as substrates. (Diethylamino)sulfur trifluoride (DAST) was used as a dual-role reagent to activate the oxime moiety and to donate a fluoride. The key intermediates, α-oximino-β-ketoesters, were prepared by highly efficient acid-assisted oximation of β-ketoesters. Then, the deconstruction of α-oximino-β-ketoesters by the fluorinative C–C bond cleavage was demonstrated to provide cyanoformates. In this event, the fluoride addition followed by the C–C bond cleavage selectively occurred in the ketones over esters. Due to simple and mild reaction conditions, variously functionalized cyanoformates were exemplified.

HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS

-

Paragraph 00925-00927, (2017/05/31)

Inhibitors of sepiapterin reductase of formula (I) or (I'), wherein the substituents are defined as in the claims, and uses of sepiapterin reductase inhibitors in analgesia, treatment of acute and chronic pain, anti-inflammation, and immune cell regulation are disclosed.

Process for producing cyanoformate esters

-

, (2008/06/13)

Alkyl, aralkyl or aryl cyanoformate esters having from one to 20 carbon atoms are prepared by anhydrously reacting stoichiometric amounts of the corresponding alkyl, aralkyl or aryl haloformate and an organosilyl nitrile in the presence of a catalytic amount of a tertiary amine base, preferably 1,4-diazabicyclo?2.2.2!octane, in the absence or presence of an inert solvent. The reaction is conducted at a temperature of from about -30° C. to 70° C., preferably at from about 5° C. to 30° C.

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