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1-{2-[4-(3-methoxy-3-oxopropyl)phenyl]-2-oxoethyl}triaza-1,2-dien-2-ium is a complex organic compound with the molecular formula C16H18N3O5. It is characterized by a triaza-1,2-dien-2-ium core, which is a heterocyclic ring system containing three nitrogen atoms. The compound features a 2-oxoethyl group attached to the triaza-1,2-dien-2-ium core, which in turn is connected to a 4-(3-methoxy-3-oxopropyl)phenyl moiety. This phenyl group has a methoxy group and a 3-oxopropyl group attached to it, adding to the complexity of the molecule. The compound is likely to be found in specialized chemical research or pharmaceutical applications due to its intricate structure.

5472-63-9

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5472-63-9 Usage

Chemical structure

A complex compound containing a triaza-1,2-dien-2-ium group attached to a phenyl ring, with a 3-methoxy-3-oxopropyl group connected to the phenyl ring.

Functional groups

The compound features a triaza-1,2-dien-2-ium group, a phenyl ring, a 3-methoxy-3-oxopropyl group, and a 2-oxoethyl group.

Potential applications

Organic synthesis, materials science, medicinal chemistry, and pharmacology.

Research and testing

Further research and testing would be needed to determine the exact properties and potential uses of the compound in various fields.

Reactivity

The presence of multiple functional groups suggests that the compound may be reactive and could potentially undergo various chemical reactions.

Stability

The stability of the compound may depend on factors such as temperature, pH, and the presence of other chemicals.

Solubility

The compound's solubility in different solvents may vary due to the presence of different functional groups.

Molecular weight

The molecular weight of the compound can be calculated based on the atomic weights of the constituent elements and their quantities in the molecule.

Structural isomers

The compound may have structural isomers, which are compounds with the same molecular formula but different arrangements of atoms.

Stereoisomers

The compound may also have stereoisomers, which are compounds with the same molecular formula and connectivity but different spatial arrangements of atoms.

Hydrogen bonding

The compound may be capable of forming hydrogen bonds due to the presence of polar functional groups.

Aromaticity

The phenyl ring in the compound is aromatic, which contributes to its stability and chemical properties.

Conjugation

The compound may exhibit conjugation, which is the alternating arrangement of single and double bonds, leading to increased stability and unique electronic properties.

Biological activity

The compound's potential biological activity and interactions with biological targets would need to be investigated through further research and testing.

Check Digit Verification of cas no

The CAS Registry Mumber 5472-63-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,7 and 2 respectively; the second part has 2 digits, 6 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 5472-63:
(6*5)+(5*4)+(4*7)+(3*2)+(2*6)+(1*3)=99
99 % 10 = 9
So 5472-63-9 is a valid CAS Registry Number.

5472-63-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 3-[4-(2-azidoacetyl)phenyl]propanoate

1.2 Other means of identification

Product number -
Other names 3-(4-azidoacetyl-phenyl)-propionic acid methyl ester

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:5472-63-9 SDS

5472-63-9Downstream Products

5472-63-9Relevant academic research and scientific papers

α-Amino ketone derivatives

-

, (2008/06/13)

The invention concerns α-aminoacyl derivatives of phenyl-, phenoxy-, thiophenoxy- and phenylsulphinylalkanoic acids together with their amides, esters and pharmaceutically acceptable salts; processes for their preparation; and pharmaceutical compositions for therapeutic use in inhibiting the formation of thrombi and also in reducing the persistence of thrombi formed in the blood of warm blooded animals. Representative compounds of the invention are methyl 4-(aminoacetyl)phenoxyacetate, 4-(aminoacetyl)phenoxyacetic acid and methyl 4-(aminoacetyl)-thiophenoxyacetate, preferably as their hydrochlorides.

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