1-Butyl-3-fluorobenzene

Base Information

Chemical Name:1-Butyl-3-fluorobenzene
CAS No.:20651-66-5
Molecular Formula:C10H13F
Molecular Weight:152.212
Hs Code.:2903999090
DSSTox Substance ID:DTXSID80174692
Nikkaji Number:J3.380.252H
Wikidata:Q83044798
Mol file:20651-66-5.mol

Synonyms:1-butyl-3-fluorobenzene;20651-66-5;Benzene, 1-butyl-3-fluoro-;1-BUTYL-3-FLUORO-BENZENE;Benzene,1-butyl-3-fluoro-;SCHEMBL1056081;DTXSID80174692;MFCD22482823;AKOS024438284

Suppliers and Price of 1-Butyl-3-fluorobenzene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
1-Butyl-3-fluorobenzene 97%
100g
$ 1068.00

Crysdot
1-Butyl-3-fluorobenzene 97%
25g
$ 427.00

Alichem
1-Butyl-3-fluorobenzene
100g
$ 1102.50

Alichem
1-Butyl-3-fluorobenzene
25g
$ 436.50

Total 7 raw suppliers

Chemical Property of 1-Butyl-3-fluorobenzene

Chemical Property:

Vapor Pressure:1.17mmHg at 25°C
Boiling Point:181.3°C at 760 mmHg
Flash Point:55.2°C
PSA：0.00000
Density:0.954g/cm³
LogP:3.16830
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:152.100128577
Heavy Atom Count:11
Complexity:101

Purity/Quality:

99% ^*data from raw suppliers

1-Butyl-3-fluorobenzene 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCC1=CC(=CC=C1)F

Technology Process of 1-Butyl-3-fluorobenzene

There total 10 articles about 1-Butyl-3-fluorobenzene 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: 95.0%

: 5369-17-5
m-(n-butyl)-aniline

: 20651-66-5
3-(n-butyl)fluorobenzene

Guidance literature:: With tetrafluoroboric acid; sodium nitrite; In cyclohexane; at 100 ℃;
DOI:10.1021/ja509144r

Reference yield: 91.0%

: 41492-05-1
p-bromobutylbenzene

: 20651-66-5
3-(n-butyl)fluorobenzene

: 20651-65-4
4-(n-butyl)fluorobenzene

Guidance literature:: With potassium fluoride; C₅₉H₇₁BrF₇OPPd; silver fluoride; cyclo-octa-1,5-diene; In cyclohexane; at 90 ℃; for 24h; Inert atmosphere; Sealed tube;
DOI:10.1021/acs.orglett.7b01082

Reference yield: 82.0%

: 1073-06-9
3-fluorobromobenzene

: 693-04-9
butyl magnesium bromide

: 20651-66-5
3-(n-butyl)fluorobenzene

Guidance literature:: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In tetrahydrofuran; at 20 - 50 ℃; for 7.5h; Inert atmosphere;