N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide

Base Information

• Chemical Name: N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide
• CAS No.: 5879-91-4
• Molecular Formula: C21H17NO3
• Molecular Weight: 330.426
• DSSTox Substance ID: DTXSID90349975
• Wikidata: Q82125615

Synonyms:N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide;5879-91-4;CBMicro_011431;Oprea1_093534;Oprea1_184163;DTXSID90349975;SMSF0009097;STK071721;AKOS000644194;CB14560;BIM-0011415.P001;SR-01000432267;SR-01000432267-1;Z28139027

Chemical Property of N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide

Chemical Property:

• Vapor Pressure: 9.12E-12mmHg at 25°C
• Boiling Point: 540.9°Cat760mmHg
• Flash Point: 280.9°C
• PSA: 47.56000
• Density: 1.275g/cm³
• LogP: 4.64450
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 331.12084340
• Heavy Atom Count: 25
• Complexity: 438

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Technology Process of N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide

There total 20 articles about N-(4-methoxyphenyl)-9H-xanthene-9-carboxamide 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: 100.0%

1-(p-hydroxyphenyl)-6-methoxy-2-phenyl-3,4-dihydronaphthalene (1729-38-0) → 4-(6-methoxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl)phenol (5879-91-4)

Guidance literature:

Pd(OH)2/C; In ethanol;

Reference yield: 95.0%

C25H26O3 → 4-(cis-6-methoxy-2-phenyltetralin-1-yl)phenol (5879-91-4,14089-22-6,14810-55-0,72105-59-0)

Guidance literature:

With trimethylsilyl bromide; In dichloromethane; at 0 ℃; for 18.5h;

DOI:10.1246/cl.2011.1272

Reference yield: 51.0%

4-(4-(benzyloxy)phenyl)-7-methoxy-3-phenyl-1,2-dihydronaphthalene (308812-06-8) → 4-(6-methoxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl)phenol (5879-91-4)

Guidance literature:

With 10 wt% Pd(OH)2 on carbon; hydrogen; In methanol; at 20 ℃; for 12h;

upstream raw materials:

1-(p-hydroxyphenyl)-6-methoxy-2-phenyl-3,4-dihydronaphthalene

4-(4-(benzyloxy)phenyl)-3-bromo-7-methoxy-1,2-dihydronaphthalene

4-(4-(benzyloxy)phenyl)-7-methoxy-3-phenyl-1,2-dihydronaphthalene

p-benzyloxyphenylbromide

Downstream raw materials:

3-[4-((1S,2R)-6-Hydroxy-2-phenyl-1,2,3,4-tetrahydro-naphthalen-1-yl)-phenoxy]-propane-1,2-diol

U₂₃₄₆₉

(5S,6R)-5-(4-Hydroxy-phenyl)-6-phenyl-5,6,7,8-tetrahydro-naphthalen-2-ol

3-{(5S,6R)-5-[4-(2,3-Dihydroxy-propoxy)-phenyl]-6-phenyl-5,6,7,8-tetrahydro-naphthalen-2-yloxy}-propane-1,2-diol

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