14213-12-8

Basic information

• Product Name: 3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE
• Synonyms: [3-(1H-tetrazol-1-yl)phenyl]amine hydrochloride;3-(1H-tetrazol-1-yl)aniline(SALTDATA: FREE);3-(1,2,3,4-tetrazol-1-yl)aniline;3-(1-tetrazolyl)aniline;3-(tetrazol-1-yl)aniline;3-(1H-tetrazol-1-yl)Benzenamine
• CAS NO: 14213-12-8
• Molecular Formula: C₇H₇N₅
• Molecular Weight: 161.17
• Mol File: 14213-12-8.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 393.7 °C at 760 mmHg
• Flash Point: 191.9 °C
• Appearance: /Solid
• Density: 1.46 g/cm³
• Vapor Pressure: 2.09E-06mmHg at 25°C
• Refractive Index: 1.749
• CAS DataBase Reference: 3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE(14213-12-8)
• EPA Substance Registry System: 3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE(14213-12-8)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 14213-12-8(Hazardous Substances Data)

Usage

Description

3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE is an organic compound characterized by the presence of a tetrazole ring and an aniline group. It is a white crystalline solid and is commonly used as a chemical intermediate in the synthesis of various pharmaceutical compounds.

Uses

Used in Pharmaceutical Industry:
3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE is used as a chemical intermediate for the synthesis of 2-methylbenzamide derivatives, which act as Nav1.1 modulators. These modulators are important in the development of drugs targeting neurological disorders, such as epilepsy and chronic pain, by modulating the activity of voltage-gated sodium channels.
The provided materials indicate that 3-(1H-TETRAZOL-1-YL)ANILINE HYDROCHLORIDE is primarily used in the pharmaceutical industry for the synthesis of Nav1.1 modulators, which have potential applications in treating neurological conditions.

InChI:InChI=1/C7H7N5/c8-6-2-1-3-7(4-6)12-5-9-10-11-12/h1-5H,8H2

Upstream product

• 14213-10-6 1-(3-nitrophenyl)-1H-1,2,3,4-tetrazole 
• 108-45-2 m-phenylenediamine 
• 122-51-0 orthoformic acid triethyl ester 
• 99-09-2 3-nitro-aniline 

Downstream Products

• 13463-91-7 N,N'-m-phenylene-di-carbamonitrile 
• 133638-22-9 3-Tetrazol-1-yl-phenyl-cyanamide 
• 847606-73-9 N'-[4-chloro-3-(trifluoromethyl)phenyl]-N-[3-(1H-tetrazol-1-yl)phenyl]glycinamide 
• 847606-72-8 (3-tetrazol-1-yl-phenyl)-hydrazine hydrochloride 
• 125620-14-6 1,3-phenylene-bis-(1H)-tetrazole 

Relevant articles and documents

Efficient reduction of nitro compounds and domino preparation of 1-substituted-1H-1,2,3,4-tetrazoles by Pd(ii)-polysalophen coated magnetite NPs as a robust versatile nanocomposite

A new, versatile, and green methodology has been developed for the efficient NaBH4-reduction of nitroarenes as well as the domino/reduction MCR preparation of 1-substituted-1H-1,2,3,4-tetrazoles using Pd(ii)-polysalophen coated magnetite NPs as an efficient heterogeneous magnetically recyclable nanocatalyst. Polysalophen was firstly prepared based on a triazine framework with a high degree of polymerization, then coordinated to Pd ions and, finally, the resulting hybrid was immobilized on magnetite NPs. The catalyst was characterized by various instrumental and analytical methods, including GPC, DLS, N2adsorption-desorption, TGA, VSM, TEM, HRTEM, EDX, XPS, XRD, and ICP analyses. The catalyst possesses dual-functionality including the reduction of nitroarenes and the construction of tetrazole rings all in one stepviaa domino protocol. High to excellent yields were obtained for both nitro reduction and the direct preparation of 1-substituted-1H-1,2,3,4-tetrazoles from nitro compounds. Insight into the mechanism was conducted by XPSin situas well as DLSin situalong with several control experiments. Recyclability of the catalyst was studied for 6 consecutive runs along with metal leaching measurements in each cycle.

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