AZIRIDINE, 1-tert-BUTYL-

Base Information

• Chemical Name: AZIRIDINE, 1-tert-BUTYL-
• CAS No.: 4017-38-3
• Molecular Formula: C6H13N
• Molecular Weight: 99.1759
• NSC Number: 152115
• UNII: WCB0V6V8H4
• DSSTox Substance ID: DTXSID30193176
• Nikkaji Number: J62.382B
• Wikidata: Q83065896
• Mol file: 4017-38-3.mol

Synonyms:1-tert-butylaziridine;1-tert-Butyaziridine;4017-38-3;AZIRIDINE, 1-tert-BUTYL-;1-tert-Butyl aziridine;tert-Butylaziridine;1-tert-Butyl-aziridine;Aziridine, 1-(1,1-dimethylethyl)-;NSC 152115;BRN 0102471;WCB0V6V8H4;AI3-50488;NSC-152115;5-20-01-00009 (Beilstein Handbook Reference);N-tert-butylaziridine;N-t-butylaziridine;NSC152115;UNII-WCB0V6V8H4;BUTYAZIRIDINE, 1-TERT-;C(C)(C)(C)N1CC1;DTXSID30193176;1-(1,1-DIMETHYLETHYL)AZIRIDINE;LS-23205

Chemical Property of AZIRIDINE, 1-tert-BUTYL-

Chemical Property:

• Vapor Pressure: 55.6mmHg at 25°C
• Boiling Point: 90.7°C at 760 mmHg
• PSA: 3.01000
• Density: 0.897g/cm³
• LogP: 1.03840
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 99.104799419
• Heavy Atom Count: 7
• Complexity: 66.7

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)N1CC1

Technology Process of AZIRIDINE, 1-tert-BUTYL-

There total 1 articles about AZIRIDINE, 1-tert-BUTYL- 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:

1-tert-Butyltriazoline → N-tert-butylaziridine (4017-38-3) + 2-[(1,1-dimethylethyl)amino]-ethanol (4620-70-6) + acetaldehyde (75-07-0,9002-91-9) + tert-butylamine (75-64-9)

Guidance literature:

With water; at 25 ℃; Rate constant; Mechanism; pH 10.75 (lysine buffer); H/D isotope effect;

DOI:10.1021/jo00060a027

Reference yield:

N-tert-butylaziridine (4017-38-3) + carbon dioxide (124-38-9,18923-20-1) → TMSO (40482-46-0)

Guidance literature:

With 1,3-bis(tert-butyl)-imidazolium-2-carboxylate; In isopropyl alcohol; at 90 ℃; for 20h; under 37503.8 Torr; Inert atmosphere; Autoclave;

DOI:10.1039/c2gc36414j

Downstream raw materials:

TMSO

Refernces