(s)-2-Benzylaziridine

Base Information

• Chemical Name: (s)-2-Benzylaziridine
• CAS No.: 73058-30-7
• Molecular Formula: C9H11N
• Molecular Weight: 133.193
• Hs Code.: 2933990090
• European Community (EC) Number: 674-663-5
• DSSTox Substance ID: DTXSID90453723
• Nikkaji Number: J1.091.971A
• Wikidata: Q72440744
• Mol file: 73058-30-7.mol

Synonyms:(s)-2-benzylaziridine;73058-30-7;(2S)-2-benzylaziridine;(S)-2-BENZYL-AZIRIDINE;Aziridine, 2-(phenylmethyl)-, (2S)-;MFCD06796591;(S)-Benzylaziridine;2beta-Benzylaziridine;SCHEMBL538540;(2S)-2-(phenylmethyl)aziridine;DTXSID90453723;LKQAJXTWYDNYHK-VIFPVBQESA-N;BCP18628;AKOS016842523;CS-W021165;AS-11452;AM20041087;EN300-7399925;A837704;Q-100799

Chemical Property of (s)-2-Benzylaziridine

Chemical Property:

• Vapor Pressure: 0.261mmHg at 25°C
• Refractive Index: 1.568
• Boiling Point: 204.589 °C at 760 mmHg
• PKA: 8.14±0.40(Predicted)
• Flash Point: 76.485 °C
• PSA: 21.94000
• Density: 1.044 g/cm³
• LogP: 1.52970
• Storage Temp.: Keep in dark place,Sealed in dry,Store in freezer, under -20°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 133.089149355
• Heavy Atom Count: 10
• Complexity: 105

Purity/Quality:

97% ^*data from raw suppliers

(S)-2-Benzylaziridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(N1)CC2=CC=CC=C2
• Isomeric SMILES: C1[C@@H](N1)CC2=CC=CC=C2

Technology Process of (s)-2-Benzylaziridine

There total 27 articles about (s)-2-Benzylaziridine 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: 99.0%

methanol (67-56-1) + (2S)-N-diphenylphosphinoyl-2-phenylmethylaziridine (156301-20-1) → (2S)-2-benzylazacyclopropane (73058-30-7) + methyl diphenylphosphinate (1706-90-7)

Guidance literature:

With boron trifluoride diethyl etherate; In dichloromethane; at 0 - 20 ℃;

DOI:10.1016/S0040-4020(97)10430-6

Reference yield: 87.0%

L-Phenylalaninol (3182-95-4) → (2S)-2-benzylazacyclopropane (73058-30-7)

Guidance literature:

L-Phenylalaninol; With sulfuric acid; at 120 ℃;

With potassium hydroxide;

DOI:10.1016/S0957-4166(02)00312-9

Reference yield: 85.0%

(R)-2-amino-3-phenylpropanol (5267-64-1) → (2S)-2-benzylazacyclopropane (73058-30-7)

Guidance literature:

With 1 M DTPP; at 60 ℃; for 48h;

DOI:10.1021/jo00351a020

upstream raw materials:

(R)-2-amino-3-phenylpropanol

methanol

(2S)-N-diphenylphosphinoyl-2-phenylmethylaziridine

n-butyllithium

Downstream raw materials:

(+)-1-(nicotinyl)-2(S)-benzylaziridine

(+)-1-(sorboyl)-2(S)-benzylaziridine

(+)-1-formyl-2(S)-benzylaziridine

(S)-2-amino-3-phenyl-1-propanethiol