2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine

Base Information

• Chemical Name: 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine
• CAS No.: 6342-10-5
• Molecular Formula: C19H17NO
• Molecular Weight: 275.35
• NSC Number: 48871,48690
• DSSTox Substance ID: DTXSID60287032
• Nikkaji Number: J2.771.279G
• Wikidata: Q82022930
• ChEMBL ID: CHEMBL1095599

Synonyms:2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine;6342-10-5;2-benzyl-1,3-dihydrobenzo[f][1,3]benzoxazine;1H-Naphtho[1,2-E][1,3]oxazine, 2-benzyl-2,3-dihydro-;NSC48871;2-benzyl-1H,3H-naphtho[1,2-e]1,3-oxazine;Oprea1_261619;2-benzyl-1H,2H,3H-naphtho[1,2-e][1,3]oxazine;CHEMBL1095599;DTXSID60287032;KYFAABULEGCMTG-UHFFFAOYSA-N;NSC48690;MFCD01426765;NSC-48690;NSC-48871;STK666128;AKOS001756806;CCG-354003;LS-08516

Chemical Property of 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine

Chemical Property:

• Vapor Pressure: 1.61E-07mmHg at 25°C
• Boiling Point: 427.6°C at 760 mmHg
• Flash Point: 125.3°C
• Density: 1.193g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 275.131014166
• Heavy Atom Count: 21
• Complexity: 339

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=C(C=CC3=CC=CC=C23)OCN1CC4=CC=CC=C4

Technology Process of 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine

There total 3 articles about 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine 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: 91.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + benzylamine (100-46-9) + β-naphthol (135-19-3) → 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine (6342-10-5)

Guidance literature:

With gum arabic-OPO₃H₂; In neat (no solvent); for 0.166667h; Catalytic behavior; Green chemistry;

DOI:10.1039/d0ra07199d

Reference yield:

1,3,5-Tribenzyl-1,3,5-triazacyclohexane (2547-66-2) + β-naphthol (135-19-3) → 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine (6342-10-5)

Guidance literature:

Multistep reaction; (i) PhCOCl, Et₂O, (ii) /BRN= 742134/, MeCN;

Reference yield:

→ 2-benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine (6342-10-5)

Guidance literature:

/BRN= 10680/;

DOI:10.1021/ja01134a039

upstream raw materials:

1,3,5-Tribenzyl-1,3,5-triazacyclohexane

β-naphthol

formaldehyd

benzylamine

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