Ethyl Pivalimidate Hydrochloride

Base Information

• Chemical Name: Ethyl Pivalimidate Hydrochloride
• CAS No.: 58910-26-2
• Molecular Formula: C7H15NO.ClH
• Molecular Weight: 165.663
• DSSTox Substance ID: DTXSID20481695
• Mol file: 58910-26-2.mol

Synonyms:Ethyl Pivalimidate Hydrochloride;58910-26-2;ethyl 2,2-dimethylpropanimidate;hydrochloride;ethyl 2,2-dimethylpropanecarboximidate hydrochloride;2,2-Dimethyl-propionimidic acid ethyl ester hydrochloride;EthylPivalimidateHydrochloride;SCHEMBL9785434;DTXSID20481695;YUIDFFWDJJNONV-UHFFFAOYSA-N;Propanimidic acid, 2,2-dimethyl-, ethyl ester, hydrochloride;MFCD00196042;SY191378;CS-0261987;EN300-80780;2,2-Dimethylpropionimidic acid ethyl ester HCl

Chemical Property of Ethyl Pivalimidate Hydrochloride

Chemical Property:

• PSA: 33.08000
• LogP: 2.94800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 165.0920418
• Heavy Atom Count: 10
• Complexity: 102

Purity/Quality:

99% ^*data from raw suppliers

2,2-Dimethyl-propionimidicacidethylesterhydrochloride 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=N)C(C)(C)C.Cl

Technology Process of Ethyl Pivalimidate Hydrochloride

There total 1 articles about Ethyl Pivalimidate 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: 100.0%

tert-butyl isocyanide (630-18-2) + ethanol (64-17-5) → ethyl 2,2-dimethylpropanimidoate hydrochloride (58910-26-2)

Guidance literature:

With hydrogenchloride; at 0 - 20 ℃; for 60h; Inert atmosphere;

Reference yield: 100.0%

ethyl 2,2-dimethylpropanimidoate hydrochloride (58910-26-2) → pivalamidine hydrochloride (18202-73-8)

Guidance literature:

With ammonia; In methanol;

DOI:10.1002/adsc.201501146

Reference yield: 83.0%

ethyl 2,2-dimethylpropanimidoate hydrochloride (58910-26-2) + phenyl chloroformate (1885-14-9) → N-(1-Ethoxy-2,2-dimethylpropyliden)carbamidsaeure-phenylester (101934-59-2)

Guidance literature:

With 2,4,6-trimethyl-pyridine; In hexane; for 22h; Heating;

upstream raw materials:

tert-butyl isocyanide

ethanol

Downstream raw materials:

3,6-di-tert-butyl-1,2,4,5-tetrazine

3-t-butyl-1,2,4,5-tetrazine

N-Benzoyl-2,2-dimethylpropionimidsaeure-ethylester

N-(1-Ethoxy-2,2-dimethylpropyliden)carbamidsaeure-phenylester