2-Methyl-3-phenylaziridine

Base Information

• Chemical Name: 2-Methyl-3-phenylaziridine
• CAS No.: 7763-71-5
• Molecular Formula: C9H11N
• Molecular Weight: 133.193
• NSC Number: 524925,101290
• UNII: VHJ2SLT9R3
• DSSTox Substance ID: DTXSID20295335
• Nikkaji Number: J2.267.747K
• Mol file: 7763-71-5.mol

Synonyms:2-Methyl-3-phenylaziridine;7763-71-5;VHJ2SLT9R3;NSC-524925;3-Methyl-2-phenylaziridine;Aziridine, 2-methyl-3-phenyl-;20993-60-6;trans-2-Methyl-3-phenylaziridine;NSC101290;UNII-VHJ2SLT9R3;2-Methyl-3-phenylaziridine #;Methyl-3-phenylaziridine, 2-;SCHEMBL1071225;DTXSID20295335;NWAQGFVFBBSDAV-UHFFFAOYSA-N;NSC524925;AKOS006352506;NSC-101290;EN300-7638626

Chemical Property of 2-Methyl-3-phenylaziridine

Chemical Property:

• Vapor Pressure: 0.225mmHg at 25°C
• Boiling Point: 207.4°Cat760mmHg
• Flash Point: 78.7°C
• Density: 0.998g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 133.089149355
• Heavy Atom Count: 10
• Complexity: 116

Purity/Quality:

90%,98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(N1)C2=CC=CC=C2

Technology Process of 2-Methyl-3-phenylaziridine

There total 9 articles about 2-Methyl-3-phenylaziridine 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: 70.0%

1-phenylpropene (637-50-3) → 2-methyl-3-phenylaziridine (7763-71-5)

Guidance literature:

With pyridine; bis{rhodium[3,3'-(1,3-phenylene)bis(2,2-dimethylpropanoic acid)]}; hydroxylamine-O-sulfonic acid; at 25 ℃; for 1h; stereospecific reaction;

DOI:10.1002/anie.201705530

Reference yield: 67.0%

2-methyl-3-phenyl-1-{[2-(trimethylsilyl)ethane]sulfonyl}aziridine (1384685-19-1) → (-)-(2S,3R)-cis-2-methyl-3-phenylaziridine (1485-13-8,7763-71-5,13148-30-6,13452-28-3,20993-60-6,61091-40-5,61091-41-6)

Guidance literature:

With tris(dimethylamino)sulfonium trimethylsilyldifluoride; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1039/c2cc32997b

Reference yield: 57.0%

(1S,2S)-(+)-1-chloro-1-phenyl-2-propylamine hydrochloride → (-)-(2S,3R)-cis-2-methyl-3-phenylaziridine (1485-13-8,7763-71-5,13148-30-6,13452-28-3,20993-60-6,61091-40-5,61091-41-6)

Guidance literature:

With sodium hydroxide; at 80 ℃;

DOI:10.1016/S0022-328X(00)00520-9

upstream raw materials:

1-phenylpropene

(1S,2R)-(+)-norphedrine

(1R,2S)-(-)-norephedrine hydrochloride

2-methyl-3-phenyl-1-{[2-(trimethylsilyl)ethane]sulfonyl}aziridine

Downstream raw materials:

Thiophosphoric acid S-(2-amino-1-phenyl-propyl) ester

(+)-[(1S,2S)-2-amino-1-phenylpropyl]-diphenylphosphine