(R)-(+)-1-Fluoro-2-octanol

Base Information

• Chemical Name: (R)-(+)-1-Fluoro-2-octanol
• CAS No.: 110270-42-3
• Molecular Formula: C8H17 F O
• Molecular Weight: 148.22
• Hs Code.: 2905590090
• DSSTox Substance ID: DTXSID40450747
• Nikkaji Number: J756.603D
• Wikidata: Q82270557
• Mol file: 110270-42-3.mol

Synonyms:(R)-(+)-1-Fluoro-2-octanol;110270-42-3;(2R)-1-FLUOROOCTAN-2-OL;2-Octanol, 1-fluoro-,(2R)-;(R)-1-Fluorooctan-2-ol;(R)-1-fluoro-2-octanol;SCHEMBL7669739;DTXSID40450747;AKOS017343272;(R)-(+)-1-Fluoro-2-octanol, 97%;( poundO pound(c) pound-(+)-1-Fluoro-2-octanol

Chemical Property of (R)-(+)-1-Fluoro-2-octanol

Chemical Property:

• Vapor Pressure: 0.069mmHg at 25°C
• Refractive Index: 1.412
• Boiling Point: 202.9°Cat760mmHg
• PKA: 14.12±0.20(Predicted)
• Flash Point: 106.2°C
• PSA: 20.23000
• Density: 0.904g/cm³
• LogP: 2.28720
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 148.126343324
• Heavy Atom Count: 10
• Complexity: 66.3

Purity/Quality:

98% ^*data from raw suppliers

(R)-(+)-1-FLUORO-2-OCTANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CF)O
• Isomeric SMILES: CCCCCC[C@H](CF)O

Technology Process of (R)-(+)-1-Fluoro-2-octanol

There total 4 articles about (R)-(+)-1-Fluoro-2-octanol 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:

1-fluoro-2-octyl acetate (115899-99-5) → (S)-(-)-1-fluoro-2-octanol + (R)-(+)-1-fluoro-2-octanol (110270-42-3)

Guidance literature:

With sodium hydroxide; water; immobilized lipase-P; Multistep reaction. Title compound not separated from byproducts; 1.) buffer, 7 h; 2.) acetone, r.t., 24 h;

DOI:10.1016/S0022-1139(00)82741-4

Reference yield:

n-hexylmagnesium bromide (3761-92-0) → (R)-(+)-1-fluoro-2-octanol (110270-42-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 63 percent / diethyl ether; hexane / 1.5 h / -78 °C

2: (-)-B-isopinocampheyl-9-borabicyclo<3.3.1>nonane / 216 h / Ambient temperature

With (-)-B-isopinocampheyl-9-borabicyclo<3.3.1>nonane; In diethyl ether; hexane;

DOI:10.1016/0957-4166(94)80057-X

Reference yield:

1-fluoro-2-octanone (590-05-6) → (S)-(-)-1-fluoro-2-octanol + (R)-(+)-1-fluoro-2-octanol (110270-42-3)

Guidance literature:

With (-)-B-isopinocampheyl-9-borabicyclo<3.3.1>nonane; for 216h; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;

DOI:10.1016/0957-4166(94)80057-X

upstream raw materials:

1-fluoro-2-octyl acetate

(R)-1,2-epoxyoctane

1-fluoro-2-octanone

n-hexylmagnesium bromide

Downstream raw materials:

2-[4-(1-monofluoromethylheptyloxymethyl)phenyl]-5-decylpyrimidine