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112809-52-6

4,4'-(4H-1,2,4-Triazol-4-ylmethylene)bis benzonitrile

CAS: 112809-52-6

Molecular Formula: C17H11N5

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112809-52-6 - Names and Identifiers

Name 4,4'-(4H-1,2,4-Triazol-4-ylmethylene)bis benzonitrile
Synonyms Iso Letrozole
AMiodarone IMpurity-B
AMiodarone IMpurity-A
Letrozole USP iMpurities
Letrozole Related CoMpound A
4,4'-(4H-1,3,4-TRIAZOL-4-YLMETHYLENE)BIS
4,4'-(4H-1,2,4-Triazol-4-ylmethylene)dibenzonitrile
4,4'-(1H-1,3,4-triazol-1-ylMethylene)dibenzonitrile
4,4'-(4H-1,2,4-TRIAZOL-4-YLMETHYLENE)BIS BENZONITRILE
4,4'-(4H-1,2,4-triazol-4-ylmethanediyl)dibenzonitrile
4,4'-(4H-1,2,4-Triazol-4-ylmethylene)bis benzonitrile
benzonitrile, 4,4'-(4H-1,2,4-triazol-4-ylmethylene)bis-
4-[(4-cyanophenyl)-(1,2,4-triazol-4-yl)methyl]benzonitrile
CAS 112809-52-6
InChI InChI=1/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-11-20-21-12-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H

112809-52-6 - Physico-chemical Properties

Molecular FormulaC17H11N5
Molar Mass285.3
Density1.21±0.1 g/cm3(Predicted)
Melting Point239-243 °C
Boling Point563.5±60.0 °C(Predicted)
Flash Point294.6°C
Solubility Chloroform (Slightly, Heated), Methanol (Slightly)
Vapor Presure1.01E-12mmHg at 25°C
AppearanceSolid
ColorOff-White to Pale Yellow
pKa2.48±0.10(Predicted)
Storage Condition2-8°C
Refractive Index1.665

112809-52-6 - Risk and Safety

HS Code2933998350

112809-52-6 - Introduction

4,4 '-(4H-1, 2,4-triazole-4-methylene) bisbenzonitrile is an organic compound with the formula C19H10N6. The following is a detailed description of the properties, uses, preparation methods and safety information of the compound:

Nature:
4,4 '-(4H-1, 2,4-triazole-4-methylene) bisbenzonitrile is a white to pale yellow crystal. It is soluble in solvents such as chloroform, dimethyl sulfoxide and ethanol. The compound has high heat and light stability.

Use:
4,4 '-(4H-1, 2,4-triazole-4-methylene) bisbenzonitrile is commonly used as an intermediate for dyes, replication materials and fluorescent stains. It can also be used in the preparation of catalysts and ligands in organic synthesis reactions, as well as fungicides.

Preparation Method:
4,4 '-(4H-1, 2,4-triazole-4-methylene) bis-benzonitrile has many preparation methods, one of which is commonly used through a series of organic synthesis reactions. The specific steps include reacting 1,4-dihydroxybenzene with tricyanourea to give 2,3-dicyanoacrylate diester, which is then condensed with benzyl alcohol under alkaline conditions to produce the target product.

Safety Information:
There are few studies on the toxicity and safety of 4,4 '-(4H-1, 2,4-triazole-4-methylene) bisbenzonitrile, so the understanding of its safety is limited. However, like other organic compounds, it may cause certain harm to the human body and the environment.

When handling this compound, take appropriate personal protective measures, such as wearing protective gloves, glasses, and protective face masks to avoid inhalation or contact with skin. Keep well ventilated during use and avoid storage or contact with substances such as oxidants and strong acids.

In addition, when using this compound, correct operating methods and laboratory safety procedures should be followed. When handling or disposing of the compound, local regulations and safe operating guidelines should be observed. If necessary, please consult a professional or relevant organization for more detailed safety information.
Last Update:2024-04-10 22:29:15
112809-52-6
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Spot supply
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Email: jy6101@rmastandards.com
Mobile: 86-15787876101
QQ: 2518299249 Click to send a QQ message
Wechat: 15787876101
Shanghai Amole Biotechnology Co., Ltd.
Spot supply
Product Name: 4,4'-((4H-1,2,4-Triazol-4-yl)methylene)dibenzonitrile Request for quotation
CAS: 112809-52-6
Tel: 400-968-2212
Email: 3623107365@qq.com
Mobile: 18916960931
QQ: 3623107365 Click to send a QQ message
Wechat: 18916960931
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112809-52-6
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