1-(3,5-Difluorophenyl)ethanol

Base Information

• Chemical Name: 1-(3,5-Difluorophenyl)ethanol
• CAS No.: 467223-90-1
• Molecular Formula: C8H8F2O
• Molecular Weight: 158.148
• Hs Code.: 2905599890
• European Community (EC) Number: 642-865-2
• DSSTox Substance ID: DTXSID60963647
• Mol file: 467223-90-1.mol

Synonyms:1-(3,5-difluorophenyl)ethanol;872181-59-4;1-(3,5-Difluorophenyl)ethan-1-ol;MFCD04038285;(alphaR)-3,5-Difluoro-alpha-methylbenzenemethanol;SCHEMBL1154665;3,5-Difluorophenylmethylcarbinol;DTXSID60963647;UEGDJZYKJPZJAA-UHFFFAOYSA-N;AKOS009158498;SB84565;AS-33197;CS-0149386;FT-0676815;FT-0762244;(+)-3,5-Difluoro-alpha-methylbenzenemethanol;EN300-105302;A862720;J-500037;J-501724;Z838968736

Chemical Property of 1-(3,5-Difluorophenyl)ethanol

Chemical Property:

• Refractive Index: 1.425
• PKA: 14.63±0.10(Predicted)
• PSA: 20.23000
• Density: 1.233±0.06 g/cm3(Predicted)
• LogP: 2.01810
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 158.05432120
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

97% ^*data from raw suppliers

3,5-Difluorophenethylalcohol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC(=CC(=C1)F)F)O

Technology Process of 1-(3,5-Difluorophenyl)ethanol

There total 2 articles about 1-(3,5-Difluorophenyl)ethanol 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: 92.0%

→ 2-(3,5-difluorophenyl)ethan-1-ol (467223-90-1)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 2h;

Reference yield: 90.0%

3,5-difluorophenyl acetic acid (105184-38-1) → 2-(3,5-difluorophenyl)ethan-1-ol (467223-90-1)

Guidance literature:

With borane-THF;

Reference yield: 88.0%

tert-butyldimethylsilyl chloride (18162-48-6) + 2-(3,5-difluorophenyl)ethan-1-ol (467223-90-1) → tert-butyl(3,5-difluorophenethoxy)dimethylsilane (1395992-22-9)

Guidance literature:

With 1H-imidazole; In N,N-dimethyl-formamide; at 20 ℃; for 72h;

upstream raw materials:

3,5-difluorophenyl acetic acid

Downstream raw materials:

3,5-difluorophenethyl iodine

C₂₃H₃₀F₂O₅

(+)-octahydro-3,6α-dimethyl-3,12-epoxy-9β-(3'-(3,5-difluorophenyl)propyl)-12H-pyrano[4,3j]-1,2-benzodioxepin-10(3H)-one

tri(1-methylethyl)silyl 2-(3,5-difluorophenyl)ethyl ether

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