6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine

Base Information

• Chemical Name: 6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine
• CAS No.: 6638-88-6
• Molecular Formula: C₁₄H₁₈BrNO
• Molecular Weight: 296.207
• NSC Number: 48472
• DSSTox Substance ID: DTXSID10286979
• Nikkaji Number: J122.183C
• Wikidata: Q82022858
• Mol file: 6638-88-6.mol

Synonyms:6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine;6638-88-6;6-bromo-3-cyclohexyl-2,4-dihydro-1,3-benzoxazine;NSC 48472;2H-1,3-Benzoxazine, 6-bromo-3-cyclohexyl-3,4-dihydro-;NSC48472;ChemDiv3_006554;DTXSID10286979;HMS1491J20;NSC-48472;STL363340;AKOS001684861;CCG-118503;IDI1_024464;2H-1, 6-bromo-3-cyclohexyl-3,4-dihydro-;6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine #

Chemical Property of 6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine

Chemical Property:

• Vapor Pressure: 1.39E-05mmHg at 25°C
• Boiling Point: 367.1°Cat760mmHg
• Flash Point: 175.8°C
• PSA: 12.47000
• Density: 1.379g/cm³
• LogP: 3.87160
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 295.05718
• Heavy Atom Count: 17
• Complexity: 255

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)N2CC3=C(C=CC(=C3)Br)OC2

Technology Process of 6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine

There total 2 articles about 6-Bromo-3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazine 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:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 4-bromo-phenol (106-41-2) + cyclohexylamine (108-91-8,157973-60-9) → 6-bromo-3-cyclohexyl-3,4-dihydro-2H-benzo[e][1,3]oxazine (6638-88-6)

Guidance literature:

DOI:10.1021/ja01123a007 DOI:10.1021/ja01170a063

Reference yield:

→ 6-bromo-3-cyclohexyl-3,4-dihydro-2H-benzo[e][1,3]oxazine (6638-88-6)

Guidance literature:

4-Brom-phenol, CH2O, Cyclohexylamin;

DOI:10.1021/jm00341a004

upstream raw materials:

formaldehyd

4-bromo-phenol

cyclohexylamine

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