5496-10-6

Basic information

• Product Name: 1-amino-1-cyanocyclohexane
• Synonyms: 1-amino-1-cyanocyclohexane;1-cyanocyclohexylamine;1-Amino-1-cyclohexanecarbonitrile;Cyclohexanecarbonitrile, 1-amino-;Einecs 226-830-5;1-aminocyclohexanecarbonitrile(SALTDATA: HCl)
• CAS NO: 5496-10-6
• Molecular Formula: C₇H₁₂N₂
• Molecular Weight: 124.18358
• EINECS: 226-830-5
• Mol File: 5496-10-6.mol
• Article Data: 18

Chemical Properties

• Melting Point: 32 °C
• Boiling Point: 236.2°C at 760 mmHg
• Flash Point: 96.6°C
• Appearance: /
• Density: 1.00±0.1 g/cm3(Predicted)
• Vapor Pressure: 0.0481mmHg at 25°C
• PKA: 4.76±0.70(Predicted)
• CAS DataBase Reference: 1-amino-1-cyanocyclohexane(CAS DataBase Reference)
• NIST Chemistry Reference: 1-amino-1-cyanocyclohexane(5496-10-6)
• EPA Substance Registry System: 1-amino-1-cyanocyclohexane(5496-10-6)

Safety Data

• Hazardous Substances Data: 5496-10-6(Hazardous Substances Data)

Usage

General Description

1-Amino-1-cyanocyclohexane is a chemical compound with the molecular formula C7H12N2. It is a cyclic amino nitrile, also known as cyclohexylcyanamine, and is commonly used in organic synthesis and chemical research. 1-amino-1-cyanocyclohexane is a white crystalline solid with a melting point of 82-86°C, and it is soluble in most organic solvents. 1-Amino-1-cyanocyclohexane is a versatile building block for the production of pharmaceuticals, agrochemicals, and fine chemicals. It is also used as a stabilizer in the synthesis of ethyleneamines and as a reagent in the preparation of various heterocyclic compounds. Additionally, it can be used as a ligand in coordination chemistry and as a chiral auxiliary in asymmetric synthesis.

InChI:InChI=1/C7H12N2/c8-6-7(9)4-2-1-3-5-7/h1-5,9H2/p+1

Upstream product

• 931-97-5 1-hydroxy-1-cyclohexanecarbonitrile 
• 17643-01-5 1,2-di-1-(1-cyano)-cyclohexylhydrazine 
• 74-90-8 hydrogen cyanide 
• 108-94-1 cyclohexanone 
• 151-50-8 potassium cyanide 
• 143-33-9 sodium cyanide 
• 1855-63-6 cyclohex-1-enecarbonitrile 
• 7664-41-7 ammonia 
• 7732-18-5 water 
• 773837-37-9 sodium cyanide 
• 75-86-5 2-hydroxy-2-methylpropanenitrile 
• 7677-24-9 trimethylsilyl cyanide 

Downstream Products

• 4550-68-9 1-acetamidocyclohexanecarbonitrile 
• 92255-24-8 1-Benzoylamino-cyclohexylnitril 
• 100957-36-6 1-(2-phenyl-acetylamino)-cyclohexanecarbonitrile 
• 702-62-5 spiro(imidazolidine-4,1'-cyclohexane)-2,5-dione 
• 2756-85-6 1-aminocyclohexane carboxylic acid 
• 41556-40-5 1,1'-imino-bis-cyclohexanecarbonitrile 
• 17324-90-2 1-aminocyclohexane-1-carboxamide 
• 21717-91-9 C₁₀H₁₃ClN₆ 
• 21725-49-5 C₁₂H₁₇ClN₆ 
• 1446756-57-5 C₁₁H₁₅ClN₆O 
• 21717-92-0 C₁₃H₁₉ClN₆ 
• 1446756-59-7 C₁₂H₁₇ClN₆ 
• 1446756-62-2 C₁₂H₁₅N₇ 
• 1446756-64-4 C₁₂H₁₈N₆O 

Relevant articles and documents

Photoreactive fused aziridinylpiperazines on the background of 4-substituted chalcones and their benzimidazolic analogs

The reaction of bromo-substituted chalcones with various diamino-compounds leads to the fused heterocyclic products, aziridinylpiperazines, exhibiting photoreactivity in the crystalline state. Crystals of 4-nitrosubstituted compounds of this family change their color from yellowish to deep violet-blue, 4-cyanosubstituted ones – from yellowish to pink at UV irradiation. Discussion on the mechanism of this phototransformation is still in progress, however, several facts points to the free radial nature of the photogenerated colored semi-products stabilized only by crystalline state of the irradiated samples. Formation of a mixture of positional isomers at interaction of bromo-chalcones with asymmetric diamines of aliphatic/alicyclic or aromatic series at synthesis of the title compounds is of significant interest as well.

SYNTHESIS OF N-(HETEROARYL)-PYRROLO[3,2-D]PYRIMIDIN-2-AMINES

This invention is in the area of synthesizing pyrimidine-based compounds useful in the treatment of disorders involving abnormal cellular proliferation, including but not limited to tumors and cancers.

Transamination of a-amino nitriles

α-Amino nitriles containing a primary amino group undergo transamination with aliphatic and aromatic amines under mild conditions with high yields. A probable reaction mechanism involving intermediate elimination of cyanide ion has been proposed.