Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans-

Base Information

• Chemical Name: Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans-
• CAS No.: 6372-57-2
• Molecular Formula: C₂₂H₁₉NO
• Molecular Weight: 313.399
• NSC Number: 619200,167332,167157
• DSSTox Substance ID: DTXSID50980166
• Nikkaji Number: J2.336.439E
• Mol file: 6372-57-2.mol

Synonyms:6372-57-2;NSC167332;SCHEMBL11248714;DTXSID50980166;UBYJCOQOPFVSFQ-UHFFFAOYSA-N;Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans-;NSC167157;NSC619200;AKOS024298299;WLN: T3NTJ AR BR& FV1R -T;NSC-167157;NSC-167332;NSC-619200;1-Benzyl-3-phenyl-2-aziridyl phenyl ketone;(1-benzyl-3-phenyl-aziridin-2-yl)-phenyl-methanone;(1-benzyl-3-phenylaziridin-2-yl)(phenyl)methanone;(1-Benzyl-3-phenyl-2-aziridinyl)(phenyl)methanone #;Ketone, 1-benzyl-3-phenyl-2-aziridinyl phenyl, trans-;6476-12-6

Chemical Property of Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans-

Chemical Property:

• Vapor Pressure: 1.94E-08mmHg at 25°C
• Boiling Point: 454.2°Cat760mmHg
• Flash Point: 171.3°C
• PSA: 20.08000
• Density: 1.187g/cm³
• LogP: 4.43290
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 313.146664230
• Heavy Atom Count: 24
• Complexity: 416

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C(C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Technology Process of Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans-

There total 17 articles about Methanone, phenyl[3-phenyl-1-(phenylmethyl)-2-aziridinyl]-, trans- 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: 88.0%

N-benzyl-N-(1,3-diphenylprop-2-yn-1-yl)hydroxylamine (294886-74-1) → (2S*,3S*)-2-benzoyl-1-benzyl-3-(phenyl)azidridine (6372-57-2,6476-12-6,72997-93-4)

Guidance literature:

With silver tetrafluoroborate; copper(l) chloride; In dichloromethane; at 20 ℃; for 20h; diastereoselective reaction;

DOI:10.1246/cl.2011.440

Reference yield: 83.0%

N-Benzylidenebenzylamine N-oxide (3376-26-9) + phenylacetylene (536-74-3) → (2S*,3S*)-2-benzoyl-1-benzyl-3-(phenyl)azidridine (6372-57-2,6476-12-6,72997-93-4)

Guidance literature:

With copper(I) trifluoromethanesulfonate * 1/2 toluene; In(hexamethyldisilazide)₂Cl; In tetrahydrofuran; at 40 ℃; for 72h;

DOI:10.1039/c4sc01332h

Reference yield: 81.0%

2-benzyl-3,5-diphenyl-2,3-dihydro-isoxazole (294886-82-1) → (2S*,3S*)-2-benzoyl-1-benzyl-3-(phenyl)azidridine (6372-57-2,6476-12-6,72997-93-4)

Guidance literature:

With copper(I) triflate benzene complex; In dichloromethane; at 20 ℃; for 4h; diastereoselective reaction;

DOI:10.1246/cl.2011.440

upstream raw materials:

trans-2,3-dibromo-1,3-diphenylpropan-1-one

benzylamine

1,3-diphenyl-propen-3-one

2-benzyl-3,5-diphenyl-2,3-dihydro-isoxazole

Downstream raw materials:

(+/-)-benzyl-(1,3,5t-triphenyl-4,5-dihydro-1H-pyrazol-4r-yl)-amine

1,3-diphenyl-propen-3-one

1,3,5-triphenyl-1H-pyrazole

benzyl 1,2-dibenzyl-4-phenyl-1H-pyrrole-3-carboxylate