1-(Phenylmethyl)-2-aziridinemethanol

Base Information

• Chemical Name: 1-(Phenylmethyl)-2-aziridinemethanol
• CAS No.: 63226-81-3
• Molecular Formula: C10H13NO
• Molecular Weight: 163.219
• DSSTox Substance ID: DTXSID10979253
• Mol file: 63226-81-3.mol

Synonyms:1-(Phenylmethyl)-2-aziridinemethanol;BRN 0119310;2-Aziridinemethanol, 1-(phenylmethyl)-;4-21-00-00003 (Beilstein Handbook Reference);63226-81-3;(1-benzylaziridin-2-yl)methanol;1-Benzyl-2-aziridinemethanol;2-Aziridinemethanol, 1-benzyl-;NIOSH/CM7920000;SCHEMBL20734689;DTXSID10979253;1-Benzyl-2-hydroxymethyl-aethylenimin;LS-23262;LS-23271;(1R,2S)-1-(benzyl)-2-aziridinemethanol;CM79200000;1-Benzyl-2-hydroxymethyl-aethylenimin [German];J-500302

Chemical Property of 1-(Phenylmethyl)-2-aziridinemethanol

Chemical Property:

• Vapor Pressure: 0.0294mmHg at 25°C
• Boiling Point: 234.3°C at 760 mmHg
• Flash Point: 98.9°C
• Density: 1.156g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 163.099714038
• Heavy Atom Count: 12
• Complexity: 143

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(N1CC2=CC=CC=C2)CO

Technology Process of 1-(Phenylmethyl)-2-aziridinemethanol

There total 7 articles about 1-(Phenylmethyl)-2-aziridinemethanol 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: 87.0%

1-benzylaziridine-2-carboxylic acid ethyl ester (34943-06-1) → 1-phenylmethyl-2-hydroxymethylaziridine (63226-81-3)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at 20 ℃; for 3h;

DOI:10.1021/acs.macromol.8b00550

Reference yield: 70.0%

methyl 1-benzylaziridine-2-carboxylate (21384-53-2,31907-91-2,196965-62-5) → 1-phenylmethyl-2-hydroxymethylaziridine (63226-81-3)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at -40 ℃;

DOI:10.1016/S0040-4020(00)01152-2

Reference yield: 50.0%

C12H15NO2 (1252059-62-3) → 1-phenylmethyl-2-hydroxymethylaziridine (63226-81-3) + 2-(benzylamino)-1-propanol (3217-09-2,6940-81-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; Reflux;

DOI:10.1039/c004960c

upstream raw materials:

methyl 1-benzylaziridine-2-carboxylate

benzylamine

C₁₂H₁₅NO₂

1-benzylaziridine-2-carboxylic acid ethyl ester

Downstream raw materials:

(RS)-3-benzyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one

1-benzyl-2-vinylaziridine

1-benzyl-2-aziridine carboxaldehyde

1-benzyl-2-benzyloxymethyl-aziridine