Octadecanoic acid, 18-fluoro-

Base Information

• Chemical Name: Octadecanoic acid, 18-fluoro-
• CAS No.: 408-37-7
• Molecular Formula: C18H35FO2
• Molecular Weight: 302.47
• DSSTox Substance ID: DTXSID00193789
• Nikkaji Number: J49.355D
• Wikidata: Q83066514
• Metabolomics Workbench ID: 1731
• Mol file: 408-37-7.mol

Synonyms:18-Fluorooctadecanoic acid;OCTADECANOIC ACID, 18-FLUORO-;408-37-7;omega-Fluorostearic acid;omega-Fluorooctadecanoic acid;18-fluoro-octadecanoic acid;BRN 1789810;18-fluorostearic acid;starbld0045471;SCHEMBL10004661;DTXSID00193789;LMFA01090045;LS-97703

Chemical Property of Octadecanoic acid, 18-fluoro-

Chemical Property:

• Vapor Pressure: 5.35E-08mmHg at 25°C
• Boiling Point: 413.6°C at 760 mmHg
• Flash Point: 203.9°C
• PSA: 37.30000
• Density: 0.928g/cm³
• LogP: 6.28210
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 302.26210852
• Heavy Atom Count: 21
• Complexity: 219

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCCCCCCCC(=O)O)CCCCCCCCF

Technology Process of Octadecanoic acid, 18-fluoro-

There total 13 articles about Octadecanoic acid, 18-fluoro- 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-chloro-7-iodo-heptane (99669-96-2) → 18‐fluorooctadecanoic acid (408-37-7)

Guidance literature:

Multi-step reaction with 6 steps

1: (i) Li, NH₃, Fe(NO₃)3, (ii) /BRN= 1697887/

2: dimethylsulfoxide

3: aq. KOH, aq. H₂O₂ / acetone

4: aq. KOH / ethanol

5: H₂, quinoline / Pd-Pb-CaCO₃ / ethyl acetate; petroleum ether

6: H₂ / Pt / ethyl acetate

With quinoline; potassium hydroxide; hydrogen; dihydrogen peroxide; Pd-Pb-CaCO₃ (Lindlar catalyst); platinum; In ethanol; dimethyl sulfoxide; ethyl acetate; acetone; Petroleum ether;

DOI:10.1021/ja00888a032

Reference yield:

8-fluoro-octan-1-ol (408-27-5) → 18‐fluorooctadecanoic acid (408-37-7)

Guidance literature:

Multi-step reaction with 8 steps

1: PBr₃

2: (i) Na, xylene, (ii) /BRN= 1735436/, DMF

3: (i) Li, NH₃, Fe(NO₃)3, (ii) /BRN= 1697887/

4: dimethylsulfoxide

5: aq. KOH, aq. H₂O₂ / acetone

6: aq. KOH / ethanol

7: H₂, quinoline / Pd-Pb-CaCO₃ / ethyl acetate; petroleum ether

8: H₂ / Pt / ethyl acetate

With quinoline; potassium hydroxide; hydrogen; dihydrogen peroxide; phosphorus tribromide; Pd-Pb-CaCO₃ (Lindlar catalyst); platinum; In ethanol; dimethyl sulfoxide; ethyl acetate; acetone; Petroleum ether;

DOI:10.1021/ja00888a032

Reference yield:

1-bromo-8-fluorooctane (593-12-4) → 18‐fluorooctadecanoic acid (408-37-7)

Guidance literature:

Multi-step reaction with 7 steps

1: (i) Na, xylene, (ii) /BRN= 1735436/, DMF

2: (i) Li, NH₃, Fe(NO₃)3, (ii) /BRN= 1697887/

3: dimethylsulfoxide

4: aq. KOH, aq. H₂O₂ / acetone

5: aq. KOH / ethanol

6: H₂, quinoline / Pd-Pb-CaCO₃ / ethyl acetate; petroleum ether

7: H₂ / Pt / ethyl acetate

With quinoline; potassium hydroxide; hydrogen; dihydrogen peroxide; Pd-Pb-CaCO₃ (Lindlar catalyst); platinum; In ethanol; dimethyl sulfoxide; ethyl acetate; acetone; Petroleum ether;

DOI:10.1021/ja00888a032

upstream raw materials:

18-fluoro-octadecan-1-ol

methyl 18-fluorostearate

ω-Fluor-oelsaeure

10-fluoro-decan-1-ol