1-Fluorobutane

Base Information

• Chemical Name: 1-Fluorobutane
• CAS No.: 2366-52-1
• Molecular Formula: C4H9F
• Molecular Weight: 76.1139
• Hs Code.: 2903399090
• European Community (EC) Number: 219-123-8
• DSSTox Substance ID: DTXSID4062351
• Nikkaji Number: J121.692I
• Wikidata: Q57985184
• Mol file: 2366-52-1.mol

Synonyms:1-FLUOROBUTANE;2366-52-1;Butane, 1-fluoro-;Butyl fluoride;EINECS 219-123-8;MFCD00039288;Butylfluorid;1-fluoro-butane;DTXSID4062351;AKOS006228780;FT-0607780;A816829

Chemical Property of 1-Fluorobutane

Chemical Property:

• Melting Point: -134°C
• Refractive Index: 1.3419
• Boiling Point: 32.8 °C at 760 mmHg
• PSA: 0.00000
• Density: 0.761 g/cm³
• LogP: 1.75600
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 76.068828449
• Heavy Atom Count: 5
• Complexity: 13.1

Purity/Quality:

98% ^*data from raw suppliers

1-Fluorobutane 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F
• Hazard Codes: F
• Statements: 10
• Safety Statements: 16

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCF

Technology Process of 1-Fluorobutane

There total 28 articles about 1-Fluorobutane 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: 80.0%

3-phenylpropanol methanesulfonate (69804-99-5) + trimethylamine trihydrofluoride → 1-fluorobutane (2366-52-1)

Guidance literature:

In acetonitrile; at 80 ℃; for 100h; Product distribution / selectivity;

Reference yield: 79.0%

butan-1-ol (71-36-3) → 1-fluorobutane (2366-52-1)

Guidance literature:

With α,α-difluoro0N,N-dimethylbenzylamine; for 0.25h; Heating;

DOI:10.1016/S0022-1139(00)85128-3

Reference yield: 77.0%

1-bromo-butane (109-65-9) → 1-fluorobutane (2366-52-1)

Guidance literature:

With tetrabutylammomium bromide; cesium fluoride; for 1h; Heating;

DOI:10.1016/0022-1139(95)03226-4

upstream raw materials:

1-bromo-butane

1-butylene

1-iodo-butane

butyl para-toluenesulfonate

Downstream raw materials:

tert-butylbenzene

2-methyl-1-phenyl-hexan-1-one

1-chloro-4-fluorobutane

chloro(fluoro)butane