4-[[(4-Fluorophenyl)imino]methyl]-phenol

Base Information

• Chemical Name: 4-[[(4-Fluorophenyl)imino]methyl]-phenol
• CAS No.: 3382-63-6
• Molecular Formula: C13H10FNO
• Molecular Weight: 215.227
• Hs Code.: 2925290090
• European Community (EC) Number: 438-950-7,636-494-5
• UNII: EJ8EYH3XGE,BA3ZMB9T4Q
• DSSTox Substance ID: DTXSID20419857
• Nikkaji Number: J1.980.425I
• Mol file: 3382-63-6.mol

Synonyms:3382-63-6;4-[[(4-Fluorophenyl)imino]methyl]-phenol;4-(((4-Fluorophenyl)imino)methyl)phenol;4-[[(4-fluorophenyl)imino]methyl]phenol;(E)-4-(((4-fluorophenyl)imino)methyl)phenol;942485-62-3;4-{[(4-Fluorophenyl)imino]methyl}phenol;4-{[(4-fluorophenyl)imino]methyl}benzenol;4-[(4-FLUOROPHENYL)IMINOMETHYL]PHENOL;Phenol, 4-[[(4-fluorophenyl)imino]methyl]-;4-[(4-fluoroanilino)methylidene]cyclohexa-2,5-dien-1-one;MFCD00029739;4-{(E)-[(4-fluorophenyl)imino]methyl}phenol;(E)-4-[[(4-Fluorophenyl)imino]methyl]phenol;4-[(E)-((4-Fluorophenyl)imino)methyl]phenol;EJ8EYH3XGE;BA3ZMB9T4Q;4-[[Imino]methyl]-phenol;SCHEMBL1033697;SCHEMBL10045762;DTXSID20419857;AM917;BCP30756;STK390972;4-(4-Hydroxybenzylidene)Fluoroaniline;4-[(4-fluorophenylimino)methyl]phenol;AKOS003407940;AKOS025149649;AKOS025401146;CS-W014894;SS-3393;4-{[(p-Fluorophenyl)imino]methyl}phenol;2-(4'-Hydrophenyl)-4-fluorobenyl imine;4-Fluoro-N-(4-hydroxybenzylidene)aniline;AC-23901;SY028062;4-[(E)(4-Fluorophenylimino)methyl]phenol;F0946;FT-0617329;FT-0668709;E-4-[[(4-Fluorophenyl)imino]methyl]-phenol;4-[(Z)-[(4-Fluorophenyl)imino]methyl]phenol;W12337;4-[[(4-Fluorophenyl)imino]methyl]phenol, (E)-;4-[[(4-Fluorophenyl)imino]methyl]phenol, (Z)-;A821953;A916761;Phenol, 4-[(E)-((4-fluorophenyl)imino)methyl]-;Phenol, 4-[(Z)-[(4-fluorophenyl)imino]methyl]-;J-513132;J-513524;1429520-29-5

Chemical Property of 4-[[(4-Fluorophenyl)imino]methyl]-phenol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 179.0 to 183.0 °C
• Refractive Index: 1.558
• Boiling Point: 370.9 °C at 760 mmHg
• PKA: 8.56±0.15(Predicted)
• Flash Point: 178.1 °C
• PSA: 32.59000
• Density: 1.13 g/cm³
• LogP: 3.28190
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 215.074642105
• Heavy Atom Count: 16
• Complexity: 228

Purity/Quality:

99.9% ^*data from raw suppliers

4-{[(p-Fluorophenyl)imino]methyl}phenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=NC2=CC=C(C=C2)F)O
• Uses: 4-{[(p-Fluorophenyl)imino]methyl}phenol is used in the preparation of benzylacetones which promote anti-fungal activity.

Technology Process of 4-[[(4-Fluorophenyl)imino]methyl]-phenol

There total 9 articles about 4-[[(4-Fluorophenyl)imino]methyl]-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: 97.5%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 4-fluoroaniline (371-40-4) → N-(4-hydroxybenzylidene)-4-fluorobenzenamine (3382-63-6,942485-62-3)

Guidance literature:

In water; at 20 - 85 ℃; for 5.5h; Large scale;

Reference yield: 91.0%

→ N-(4-hydroxybenzylidene)-4-fluorobenzenamine (3382-63-6,942485-62-3)

Guidance literature:

Reference yield: 88.0%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 4-fluoroaniline (371-40-4) → (E)-(4-hydroxy-benzylidene)-(4-fluorophenyl)-amine (3382-63-6,942485-62-3)

Guidance literature:

In isopropyl alcohol; at 20 - 50 ℃; for 1.5h;

upstream raw materials:

4-hydroxy-benzaldehyde

4-fluoroaniline

ezetemibe

p-azidofluorobenzene

Downstream raw materials:

(Z)-1-(4-(benzyloxy)phenyl)-N-(4-fluorophenyl)methaneimine

C₁₆H₁₈FNOSi

(S)-3-{(R)-2-[(S)-(4-fluorophenylamino)-(4-hydroxyphenyl)methyl]-4-[2-(4-fluorophenyl)-[1,3]-dioxolan-2-yl]butyryl}-4-phenyloxazolidin-2-one

C₄₁H₃₄F₂N₂O₇

Refernces

• 1、 Ha, Sie-Tiong,Lee, Teck-Leong,Lee, Siew-Ling,Yeap, Guan-Yeow,Lin, Hong-Cheu,Ito, Masato M.. "Mesomorphic properties and X-ray diffraction studies of 4-alkanoyloxybenzylidene-4′-fluoroaniline". . p. 7737 - 7740. Retrieved 2014.
• 2、 Cao, Chao-Tun,Cheng, Shimao,Zhang, Jingyuan,Cao, Chenzhong. "Effect of substituents on the UV spectra of supermolecular system: Silver nanoparticles with bi-aryl Schiff bases containing hydroxyl". . . Retrieved 2018/11/25.
• 3、 -. "Production method of Ezetimibe intermediate". Paragraph 0029; 0030; 0031. . Retrieved 2017/08/29.