Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl-

Base Information

• Chemical Name: Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl-
• CAS No.: 482620-70-2
• Molecular Formula: C15H15NO
• Molecular Weight: 225.29
• DSSTox Substance ID: DTXSID90454699
• Wikidata: Q82276379
• Mol file: 482620-70-2.mol

Synonyms:482620-70-2;Methanone,[4-[(1R)-1-aminoethyl]phenyl]phenyl-;Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl-;{4-[(1R)-1-Aminoethyl]phenyl}(phenyl)methanone;DTXSID90454699

Chemical Property of Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl-

Chemical Property:

• PSA: 43.09000
• LogP: 3.63760
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 225.115364102
• Heavy Atom Count: 17
• Complexity: 250

Purity/Quality:

99% ，98% ^*data from raw suppliers

[4-[(1R)-1-AMINOETHYL]PHENYL]PHENYL-METHANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)N
• Isomeric SMILES: C[C@H](C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)N

Technology Process of Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl-

There total 13 articles about Methanone, [4-[(1R)-1-aminoethyl]phenyl]phenyl- 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: 74.2%

4-(1-azidoethyl)benzophenone (482620-66-6) → 4-(1-aminoethyl)benzophenone (482620-67-7,482620-70-2)

Guidance literature:

With water; triphenylphosphine; In tetrahydrofuran; for 20h; Heating;

DOI:10.1021/jo020630e

Reference yield: 64.0%

(R)-N-[(R)-1-(4-Benzoyl-phenyl)-ethyl]-2-hydroxy-2-phenyl-acetamide (482620-69-9) → 4-[(1R)-aminoethyl]benzophenone (482620-70-2)

Guidance literature:

With hydrogenchloride; In water; for 14h; Heating;

DOI:10.1021/jo020630e

Reference yield:

4-ethylbenzophenone (18220-90-1) → 4-[(1S)-aminoethyl]benzophenone (482620-71-3,482620-70-2)

Guidance literature:

Multi-step reaction with 5 steps

1: 74 percent / N-bromosuccinimide; benzoyl peroxide / CCl₄ / 12 h / Heating

2: 96 percent / NaN₃ / dimethylformamide / 11 h / 20 °C

3: 74.2 percent / triphenylphosphine; H₂O / tetrahydrofuran / 20 h / Heating

4: 8.2 g / dicyclohexylcarbodiimide; 1-hydroxybenzotriazole / CH₂Cl₂ / 14 h / 0 - 20 °C

5: hydrochloric acid / H₂O / 14 h / Heating

With hydrogenchloride; N-Bromosuccinimide; sodium azide; water; benzotriazol-1-ol; dicyclohexyl-carbodiimide; triphenylphosphine; dibenzoyl peroxide; In tetrahydrofuran; tetrachloromethane; dichloromethane; water; N,N-dimethyl-formamide;

DOI:10.1021/jo020630e

upstream raw materials:

4-(1-azidoethyl)benzophenone

4-ethylbenzophenone

[4-(1-bromoethyl)phenyl](phenyl)methanone

(R)-N-[(S)-1-(4-Benzoyl-phenyl)-ethyl]-2-hydroxy-2-phenyl-acetamide

Refernces