Tert-butyl 2-methylaziridine-1-carboxylate

Base Information

• Chemical Name: Tert-butyl 2-methylaziridine-1-carboxylate
• CAS No.: 129319-71-7
• Molecular Formula: C8H15NO2
• Molecular Weight: 157.213
• DSSTox Substance ID: DTXSID10449128
• Nikkaji Number: J779.479G
• Mol file: 129319-71-7.mol

Synonyms:Tert-butyl 2-methylaziridine-1-carboxylate;129319-71-7;SCHEMBL344752;SCHEMBL344753;SCHEMBL5986860;DTXSID10449128;VQLIJOWSVJKBFP-HSOSERFQSA-N;VQLIJOWSVJKBFP-IOJJLOCKSA-N;VQLIJOWSVJKBFP-UHFFFAOYSA-N;1-Aziridinecarboxylic acid, 2-methyl-, 1,1-dimethylethyl ester;AMY37265;CS-B1213;MFCD22665811;AKOS022171611;DS-5692;N-tert-butoxycarbonyl-2-methylaziridine;SB45140;Tert-butyl2-methylaziridine-1-carboxylate;FT-0722009;Y10760;(R)-(-)-N-tert-butoxycarbon-yl-2-methylaziridine;(R)-(-)-N-tert-butoxycarbonyl-2-methylaziridine;(S)-(+)-N-tert-butoxycarbonyl-2-methylaziridine;A888869;2-Methylaziridine-1-carboxylic acid tert-butyl ester

Chemical Property of Tert-butyl 2-methylaziridine-1-carboxylate

Chemical Property:

• Storage Temp.: 2-8°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 171

Purity/Quality:

97% ^*data from raw suppliers

tert-Butyl2-methylaziridine-1-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN1C(=O)OC(C)(C)C

Technology Process of Tert-butyl 2-methylaziridine-1-carboxylate

There total 4 articles about Tert-butyl 2-methylaziridine-1-carboxylate 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%

di-tert-butyl dicarbonate (24424-99-5) + 2-Methylaziridine (75-55-8,41927-28-0,76612-76-5,76612-77-6,205537-16-2) → (+/-)-N-(tert-Butoxycarbonyl)-2-methylaziridine (129319-71-7)

Guidance literature:

With triethylamine; In dichloromethane; 0 deg C, 3 h; r.t., 1 h;

DOI:10.1016/0040-4020(95)00751-S

Reference yield: 56.7%

tert-butyl 2-hydroxypropylcarbamate (95656-86-3,119768-44-4,138457-45-1) → (+/-)-N-(tert-Butoxycarbonyl)-2-methylaziridine (129319-71-7)

Guidance literature:

With potassium hydroxide; p-toluenesulfonyl chloride; In tetrahydrofuran; at 20 - 22 ℃;

DOI:10.1039/b102895m

Reference yield: 27.0%

tert-butyl (1-hydroxypropan-2-yl)carbamate (147252-84-4,79069-13-9,106391-86-0,127516-56-7) → (+/-)-N-(tert-Butoxycarbonyl)-2-methylaziridine (129319-71-7)

Guidance literature:

With p-toluenesulfonyl chloride; potassium hydroxide; In diethyl ether; at 50 ℃; for 3h;

DOI:10.1021/jacs.0c01724

upstream raw materials:

di-tert-butyl dicarbonate

2-Methylaziridine

tert-butyl 2-hydroxypropylcarbamate

tert-butyl (1-hydroxypropan-2-yl)carbamate

Downstream raw materials:

[(E)-1-Methyl-3-(2,4,6-trimethyl-phenyl)-allyl]-carbamic acid tert-butyl ester

((E)-1-Methyl-3-phenyl-allyl)-carbamic acid tert-butyl ester

[(E)-3-(4-Methoxy-phenyl)-1-methyl-allyl]-carbamic acid tert-butyl ester

[(E)-3-(3-Chloro-phenyl)-1-methyl-allyl]-carbamic acid tert-butyl ester