1-Fluorodecane

Base Information

• Chemical Name: 1-Fluorodecane
• CAS No.: 334-56-5
• Molecular Formula: C10H21 F
• Molecular Weight: 160.275
• Hs Code.: 2903399090
• European Community (EC) Number: 206-380-6
• DSSTox Substance ID: DTXSID5059826
• Nikkaji Number: J40.813A
• Wikidata: Q81988965
• Mol file: 334-56-5.mol

Synonyms:1-FLUORODECANE;334-56-5;Decane, 1-fluoro-;Decyl fluoride;1-fluoro-decane;n-Decyl fluoride;BRN 1735222;EINECS 206-380-6;1-fluoranyldecane;1-Fluorodecane, 98%;SCHEMBL113425;DTXSID5059826;C10H21F;C10-H21-F;MFCD00018074;AKOS006220482;LS-59331;FT-0607781;F87352;METHYL4-(2-BROMOETHOXY)BENZENECARBOXYLATE;A821783;J-019192

Chemical Property of 1-Fluorodecane

Chemical Property:

• Vapor Pressure: 0.927mmHg at 25°C
• Melting Point: -35°C
• Refractive Index: n20/D 1.409(lit.)
• Boiling Point: 186.1°Cat760mmHg
• Flash Point: 106.1°C
• PSA: 0.00000
• Density: 0.805g/cm³
• LogP: 4.09660
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 160.162728832
• Heavy Atom Count: 11
• Complexity: 61.9

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-Fluorodecane 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T+,N,F
• Hazard Codes: T+,N,F
• Statements: 28-50/53
• Safety Statements: 28-36/37-45-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCF

Technology Process of 1-Fluorodecane

There total 17 articles about 1-Fluorodecane 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: 100.0%

decyl p-toluenesulfonate (5509-08-0) → 1-fluorodecane (334-56-5)

Guidance literature:

With tris(diethylamino)methylaminophosphonium bifluoride; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; at 95 ℃; for 3h;

Reference yield: 87.0%

Iododecane (2050-77-3) → 1-fluorodecane (334-56-5)

Guidance literature:

With triethylamine tris(hydrogen fluoride); In dichloromethane; at 20 ℃; Electrochemical reaction;

Reference yield: 77.0%

C22H31S(1+)*BF4(1-) → 1-fluorodecane (334-56-5)

Guidance literature:

With potassium fluoride; In dichloromethane; water; at 50 ℃; for 82h;

upstream raw materials:

methanesulfonic acid decyl ester

1-Bromopentane

1-bromo dodecane

2-decyl-1,1-diphenyl-isourea; hydrofluoride

Downstream raw materials:

2-decylcyclohexanone

decane

octane

nonane

Refernces

• 1、 Epifanov, Maxim,Lai, Joey,Lee, Cayo,Sammis, Glenn M.,Wang, Cindy Xinyun. "Efficient protocol for the SO2F2-mediated deoxyfluorination of aliphatic alcohols". supporting information. . Retrieved 2021/09/28.
• 2、 Ma, Xinghua,Diane, Mohamed,Ralph, Glenn,Chen, Christine,Biscoe, Mark R.. "Stereospecific Electrophilic Fluorination of Alkylcarbastannatrane Reagents". . p. 12663 - 12667. Retrieved 2017/09/11.