2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid

Base Information

• Chemical Name: 2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid
• CAS No.: 126582-18-1
• Molecular Formula: C22H18 O3
• Molecular Weight: 330.38
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID70377337
• Mol file: 126582-18-1.mol

Synonyms:2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid;DTXSID70377337;AKOS030241387;FT-0680519

Chemical Property of 2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid

Chemical Property:

• Vapor Pressure: 2.76E-10mmHg at 25°C
• Melting Point: 218-221°C
• Refractive Index: 1.654
• Boiling Point: 486.7°Cat760mmHg
• Flash Point: 170.4°C
• PSA: 46.53000
• Density: 1.215g/cm³
• LogP: 4.89080
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 330.125594432
• Heavy Atom Count: 25
• Complexity: 436

Purity/Quality:

98%min ^*data from raw suppliers

3-[4-(Benzyloxy)phenyl]-2-phenylacrylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C3=CC=CC=C3)C(=O)O

Technology Process of 2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid

There total 1 articles about 2-phenyl-3-(4-phenylmethoxyphenyl)prop-2-enoic Acid 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: 51.0%

phenylacetic acid (103-82-2) + p-benzyloxybenzaldehyde (4397-53-9) → 2-phenyl-3-(4-benzyloxyphenyl)acrylic acid (126582-18-1)

Guidance literature:

With triethylamine; In acetic anhydride; Heating;

Reference yield: 84.0%

2-phenyl-3-(4-benzyloxyphenyl)acrylic acid (126582-18-1) → cis-1-phenyl-2-(4-benzyloxyphenyl)stilbene (126582-21-6)

Guidance literature:

With CuO/Cr₂O₃; In quinoline; at 180 - 190 ℃; for 2h;

Reference yield:

2-phenyl-3-(4-benzyloxyphenyl)acrylic acid (126582-18-1) → 1,1-dichloro-cis-2-(4-hydroxyphenyl)-3-phenylcyclopropane (126582-28-3,142119-27-5)

Guidance literature:

Multi-step reaction with 3 steps

1: 84 percent / CuO*Cr₂O₃ / quinoline / 2 h / 180 - 190 °C

2: 69 percent / NaOH, TEBA / 24 h / Ambient temperature

3: H₂ / palladium-carbon / ethanol / 5 h

With sodium hydroxide; CuO/Cr₂O₃; N-benzyl-N,N,N-triethylammonium chloride; hydrogen; palladium on activated charcoal; In quinoline; ethanol;

upstream raw materials:

phenylacetic acid

p-benzyloxybenzaldehyde

Downstream raw materials:

cis-1-phenyl-2-(4-benzyloxyphenyl)stilbene

1,1-dichloro-cis-2-(4-benzyloxyphenyl)-3-phenylcyclopropane

1,1-dichloro-cis-2-(4-hydroxyphenyl)-3-phenylcyclopropane

1-Benzyloxy-4-((1S,2R)-2-phenyl-cyclopropyl)-benzene

Refernces