4-(1-Ethyl-2-phenylbutyl)phenol

Base Information

• Chemical Name: 4-(1-Ethyl-2-phenylbutyl)phenol
• CAS No.: 3929-22-4
• Molecular Formula: C₁₈H₂₂O
• Molecular Weight: 254.372
• Hs Code.: 2907199090
• NSC Number: 24234
• DSSTox Substance ID: DTXSID50282096
• Nikkaji Number: J2.792.398D
• Wikidata: Q27148723
• Mol file: 3929-22-4.mol

Synonyms:4-(1-Ethyl-2-phenylbutyl)phenol;4-(4-phenylhexan-3-yl)phenol;3929-22-4;CHEBI:79601;DTXSID50282096;NSC24234;NSC-24234;Q27148723

Chemical Property of 4-(1-Ethyl-2-phenylbutyl)phenol

Chemical Property:

• Vapor Pressure: 1.72E-05mmHg at 25°C
• Boiling Point: 353.8°Cat760mmHg
• Flash Point: 164.9°C
• PSA: 20.23000
• Density: 1.021g/cm³
• LogP: 5.07960
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 254.167065321
• Heavy Atom Count: 19
• Complexity: 236

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(1-Ethyl-2-phenylbutyl)phenol

There total 5 articles about 4-(1-Ethyl-2-phenylbutyl)phenol 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:

3-phenyl-4-(p-anisyl)hexane (345221-11-6) → 4-(1-ethyl-2-phenyl-butyl)-phenol (3929-22-4)

Guidance literature:

With hydrogen bromide; acetic acid; optically inactive substance of mp: 144 degree;

DOI:10.1021/ja01211a007

Reference yield:

3-phenyl-4-(p-anisyl)hexane (345221-11-6) → 4-(1-ethyl-2-phenyl-butyl)-phenol (3929-22-4)

Guidance literature:

With hydrogen bromide; acetic acid; optically inactive substance of bp _0.07: 153 degree;

DOI:10.1021/ja01211a007

Reference yield:

5-Chloro-1-phenyltetrazole (14210-25-4) + hexestrol (84-16-2,26614-21-1) → meso-3,4-diphenyl-hexane (39952-67-5) + deoxyhexestrol (3929-22-4,5776-73-8,5776-74-9)

Guidance literature:

With hydrogen; potassium carbonate; palladium on activated charcoal; Yield given. Multistep reaction. Yields of byproduct given; 1.) acetone, reflux, 17 h, 2.) ethanol, 37 psi, 35 deg C;

DOI:10.1021/jm00136a013

upstream raw materials:

methyl magnesium iodide

3-phenyl-4-(p-anisyl)hexane

5-Chloro-1-phenyltetrazole

hexestrol

Downstream raw materials:

1-(1-ethyl-2-phenyl-butyl)-4-benzoyloxy-benzene

4-Nitro-benzenesulfonic acid 4-((1R,2S)-1-ethyl-2-phenyl-butyl)-phenyl ester

erythro-3-(4-aminophenyl)-4-(4-hydroxyphenyl)hexane

erythro-3-(p-hydroxyphenyl)-4-(p-acetylphenyl)hexane