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1-(2-phenyl-2H-1,2,3-triazol-4-yl)butane-1,2,3-triyl tribenzoate is a complex organic compound with the molecular formula C30H21N3O6. It is a derivative of 1,2,3-triazole, a five-membered heterocyclic ring containing three nitrogen atoms. The compound features a central butane-1,2,3-triyl moiety, which connects three benzoate groups, and a 2-phenyl-2H-1,2,3-triazol-4-yl group attached to the terminal carbon atom. This chemical structure endows the molecule with unique properties, making it potentially useful in various applications, such as pharmaceuticals, materials science, and chemical research. The synthesis of 1-(2-phenyl-2H-1,2,3-triazol-4-yl)butane-1,2,3-triyl tribenzoate typically involves multi-step reactions, including the formation of the 1,2,3-triazole ring and the subsequent attachment of the benzoate groups. Due to its complexity, the compound may require specialized handling and storage conditions to maintain its stability and reactivity.

7596-26-1

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7596-26-1 Usage

Molecular structure

The compound has a benzene ring connected to a 1,2,3-triazole ring, which is connected to a butane-1,2,3-triyl group. The butane-1,2,3-triyl group is esterified with three benzoyl (benzoate) groups.

Functional groups

Benzene ring, 1,2,3-triazole ring, butane-1,2,3-triyl group, and three benzoyl (benzoate) ester groups.

Applications

Commonly used as an intermediate in organic synthesis, with potential applications in the pharmaceutical and materials industries.

Versatility

The unique structure allows for various functionalizations and modifications, making it a versatile building block in chemical research and development.

Physical properties

The specific physical properties (e.g., melting point, boiling point, solubility) are not provided in the material, but they can be determined through experimental analysis.

Chemical properties

The compound is likely to exhibit reactivity due to the presence of the ester groups, which can undergo hydrolysis or transesterification reactions. The aromatic rings and the 1,2,3-triazole ring may also participate in various electrophilic and nucleophilic substitution reactions.

Stability

The stability of the compound under different conditions (e.g., temperature, pH, light exposure) is not provided in the material, but it can be assessed through experimental studies.

Synthesis

The synthesis of 1-(2-phenyl-2H-1,2,3-triazol-4-yl)butane-1,2,3-triyl tribenzoate typically involves the formation of the benzene-1,2,3-triazole ring, followed by the attachment of the butane-1,2,3-triyl group and subsequent esterification with benzoyl groups.

Hazards and safety

The specific hazards and safety precautions for handling 1-(2-phenyl-2H-1,2,3-triazol-4-yl)butane-1,2,3-triyl tribenzoate are not provided in the material, but they should be determined based on the compound's chemical properties and potential reactivity.

Check Digit Verification of cas no

The CAS Registry Mumber 7596-26-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 7,5,9 and 6 respectively; the second part has 2 digits, 2 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 7596-26:
(6*7)+(5*5)+(4*9)+(3*6)+(2*2)+(1*6)=131
131 % 10 = 1
So 7596-26-1 is a valid CAS Registry Number.

7596-26-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name [3,4-dibenzoyloxy-4-(2-phenyltriazol-4-yl)butan-2-yl] benzoate

1.2 Other means of identification

Product number -
Other names (3-methylcyclohexane-1,2-diyl)dimethanediyl diacetate

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:7596-26-1 SDS

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