2-Amino-2-methylpropanenitrile hydrochloride

Base Information

• Chemical Name: 2-Amino-2-methylpropanenitrile hydrochloride
• CAS No.: 50846-36-1
• Molecular Formula: C4H8N2.ClH
• Molecular Weight: 120.582
• Hs Code.: 2926909090
• European Community (EC) Number: 814-194-7
• DSSTox Substance ID: DTXSID80481919
• Mol file: 50846-36-1.mol

Synonyms:2-amino-2-methylpropanenitrile hydrochloride;50846-36-1;2-Amino-2-methylpropionitrile hydrochloride;2-AMINO-2-METHYLPROPANENITRILE HCL;MFCD08456816;2-amino-2-methylpropanenitrile;hydrochloride;Propanenitrile, 2-amino-2-methyl-, monohydrochloride;2-Amino-2-methyl-propionitrile hydrochloride;SCHEMBL696386;DTXSID80481919;2-amino-2-methylpropionitrile hcl;RWPZHHGTDNTPFY-UHFFFAOYSA-N;2-amino-2-methylpropanenitrile-HCl;AKOS015914088;CS-W005215;SB75380;AS-18387;SY046540;2-amino-2-methylpropanenitrilehydrochloride;EN300-87955;A871440

Chemical Property of 2-Amino-2-methylpropanenitrile hydrochloride

Chemical Property:

• Melting Point: 147-149℃
• PSA: 49.81000
• LogP: 1.74958
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 120.0454260
• Heavy Atom Count: 7
• Complexity: 85

Purity/Quality:

98% ^*data from raw suppliers

2-Amino-2-methylpropanenitrileHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C#N)N.Cl

Technology Process of 2-Amino-2-methylpropanenitrile hydrochloride

There total 4 articles about 2-Amino-2-methylpropanenitrile hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 83.0%

2-tert-Butyloxycarbonylamino-2-methylpropiononitrile → 2-amino-2-methylpropanenitrile monohydrochloride (50846-36-1)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 0 - 20 ℃; for 2.5h;

Reference yield: 30.0%

potassium cyanide + acetone (67-64-1) → 2-amino-2-methylpropanenitrile monohydrochloride (50846-36-1)

Guidance literature:

potassium cyanide; acetone; With ammonium chloride; In water; at 25 ℃; for 40h;

With hydrogenchloride; In diethyl ether; at 0 ℃;

DOI:10.1039/b719675j

Reference yield:

2-amino-2-cyanopropane (19355-69-2) → 2-amino-2-methylpropanenitrile monohydrochloride (50846-36-1)

Guidance literature:

With hydrogenchloride; In diethyl ether; at 0 ℃; for 0.5h;

upstream raw materials:

potassium cyanide

acetone

2-amino-2-cyanopropane

Downstream raw materials:

2,2,5,5-tetramethylimidazolidine-4-thione

(cyano-dimethyl-methyl)carbamic acid benzyl ester

(1R,2R,4R)-4-benzenesulfonyl-2-(morpholine-4-carbonyl)cyclopentanecarboxylic acid (cyanodimethylmethyl)amide

(1-Cyan-1-methylethyl)harnstoff

Refernces

• 1、 Murray, Ross G.,Whitehead, David M.,Le Strat, Franck,Conway, Stuart J.. "Facile one-pot synthesis of 5-substituted hydantoins". supporting information; scheme or table. p. 988 - 991. Retrieved 2009/02/05.
• 2、 -. "Dipeptide nitriles". Page column 30. . Retrieved 2010/02/05.