1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo, also known as 4-chlorophenyl-1,2,4-triazine-6-carboxylic acid, is a chemical compound with the molecular formula C9H7ClN3O3. It is a derivative of 1,2,4-triazine, a heterocyclic compound consisting of three nitrogen atoms and three carbon atoms in a six-membered ring. The compound features a 4-chlorophenyl group attached to the 2-position of the triazine ring, and a carboxylic acid group at the 6-position. Additionally, it has a tetrahydro structure with two carbonyl groups at the 3 and 5 positions. 1,2,4-Triazine-6-carboxylic acid,
2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo- is primarily used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals, such as herbicides and fungicides, due to its unique chemical structure and reactivity.
4315-73-5
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Basic information
- Product Name: 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-
- Synonyms: 1-(4-Chlor-phenyl)-6-aza-uracil-5-carbonsaeure;2-(4-Chloro-phenyl)-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid;
- CAS NO:4315-73-5
- Molecular Formula: C10H6ClN3O4
- Molecular Weight: 267.62500
- EINECS: N/A
- Product Categories: N/A
- Mol File: 4315-73-5.mol
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Chemical Properties
- Melting Point: 216 °C (H2O)
- Boiling Point: N/A
- Flash Point: N/A
- Appearance: N/A
- Density: 1.72±0.1 g/cm3(Predicted)
- Refractive Index: N/A
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-(CAS DataBase Reference)
- NIST Chemistry Reference: 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-(4315-73-5)
- EPA Substance Registry System: 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-(4315-73-5)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 4315-73-5(Hazardous Substances Data)
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Chemical structure
1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxois a chemical compound that contains a 1,2,4-triazine ring, a carboxylic acid group, a 4-chlorophenyl group, and a tetrahydro-3,5-dioxo moiety.Applications
It is often used in organic synthesis as a building block for the preparation of various derivatives and has potential applications in the pharmaceutical industry, particularly in the development of new drugs.Binding interactions
The presence of the carboxylic acid and chlorophenyl groups in its structure suggests that it may have strong binding interactions with biological targets, making it an interesting candidate for further research and development.Chemical properties
As a carboxylic acid, it has acidic properties and can form salts and esters. The presence of the 1,2,4-triazine ring and the tetrahydro-3,5-dioxo moiety may also contribute to its chemical reactivity and stability.Physical properties
The specific physical properties of 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-, such as its melting point, boiling point, and solubility, would depend on its molecular weight, structure, and functional groups. However, these properties have not been provided in the material.Safety
As with any chemical compound, appropriate safety precautions should be taken when handling 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-, including the use of personal protective equipment and proper disposal methods. The specific safety information for 1,2,4-Triazine-6-carboxylic acid, 2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo- has not been provided in the material.Check Digit Verification of cas no
The CAS Registry Mumber 4315-73-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,3,1 and 5 respectively; the second part has 2 digits, 7 and 3 respectively.Calculate Digit Verification of CAS Registry Number 4315-73:
(6*4)+(5*3)+(4*1)+(3*5)+(2*7)+(1*3)=75
75 % 10 = 5
So 4315-73-5 is a valid CAS Registry Number.
4315-73-5Upstream product
4315-73-5Downstream Products
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1,2,4-Triazine-6-carboxylic acid,
2-(4-chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-
