5-Fluoroindole

Base Information Edit

Chemical Name:5-Fluoroindole
CAS No.:399-52-0
Molecular Formula:C8H6FN
Molecular Weight:135.141
Hs Code.:29339900
European Community (EC) Number:206-917-4
NSC Number:88613
UNII:ZL8W3FGT5K
DSSTox Substance ID:DTXSID10192940
Nikkaji Number:J213.642B
Wikidata:Q27140165
Metabolomics Workbench ID:66128
ChEMBL ID:CHEMBL555457
Mol file:399-52-0.mol

Synonyms:5-fluoroindole

Suppliers and Price of 5-Fluoroindole

Supply Marketing:Edit

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

TRC
5-Fluoroindole
10g
$ 45.00

TCI Chemical
5-Fluoroindole >98.0%(GC)
5g
$ 47.00

TCI Chemical
5-Fluoroindole >98.0%(GC)
1g
$ 14.00

SynQuest Laboratories
5-Fluoro-1H-indole 98%
5 g
$ 40.00

Sigma-Aldrich
5-Fluoroindole 98%
1g
$ 52.10

Oakwood
5-Fluoroindole
25g
$ 120.00

Oakwood
5-Fluoroindole
1g
$ 10.00

Oakwood
5-Fluoroindole
5g
$ 30.00

Matrix Scientific
5-Fluoroindole 96+%
5g
$ 22.00

J&W Pharmlab
5-Fluoro-1H-indole 97%
100g
$ 360.00

Total 126 raw suppliers

Chemical Property of 5-Fluoroindole Edit

Chemical Property:

Appearance/Colour:off-white crystalline powder
Melting Point:45-48 °C(lit.)
Boiling Point:258 °C at 760 mmHg
PKA:16.16±0.30(Predicted)
Flash Point:109.9 °C
PSA：15.79000
Density:1.273 g/cm³
LogP:2.30700
Storage Temp.:2-8°C
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:135.048427358
Heavy Atom Count:10
Complexity:126

Purity/Quality:

99% ^*data from raw suppliers

5-Fluoroindole ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC2=C(C=CN2)C=C1F
Uses ? ;Reactant for preparation of 5-HT6 receptor ligands1? ;Reactant for preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators2? ;Reactant for preparation of antitumor agents3? ;Reactant for preparation of antibacterial agents4? ;Reactant for preparation of immunosuppressive agents5? ;Reactant for preparation of Sodium-Dependent Glucose Co-transporter 2 (SGLT2) Inhibitors for the Management of Hyperglycemia in Diabetes6? ;Reactant for preparation of Myeloperoxidase Inhibitors7? ;Reactant fo 5-Fluoroindole is a reactant used in various syntheses. It was used in the synthesis of Spirotetrahydro β-Carbolines (Spiroindolones), which is a new class of potent and orally efficacious compounds for the treatment of malaria. 5-Fluoroindole was also a reactant in direct indole and pyrrole couplings to carbonyl compound in total synthesis of Acremoauxin A and Oxazinin 3. Reactant for preparation of 5-HT6 receptor ligandsReactant for preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulatorsReactant for preparation of antitumor agentsReactant for preparation of antibacterial agentsReactant for preparation of immunosuppressive agentsReactant for preparation of Sodium-Dependent Glucose Co-transporter 2 (SGLT2) Inhibitors for the Management of Hyperglycemia in DiabetesReactant for preparation of Myeloperoxidase InhibitorsReactant for preparation of Potent Selective Serotonin Reuptake Inhibitors

Technology Process of 5-Fluoroindole

There total 32 articles about 5-Fluoroindole 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: 99.0%

: 2343-22-8
5-fluoroindoline

: 399-52-0
5-fluoro-1H-indole

Guidance literature:: With 6C₄₄H₃₂N₆O₄Ru⁽²⁺⁾*12Hf⁽²⁺⁾*8O^(2-)*14HO^(1-)*6C₁₆H₂₂ClCoN₅O₆^(1-); In 2,2,2-trifluoroethanol; acetonitrile; at 20 ℃; for 12h; Catalytic behavior; Inert atmosphere; Irradiation;
DOI:10.1002/anie.202011519

Reference yield: 96.0%

: 399-76-8
5-fluoroindole-2-carboxylic acid

: 399-52-0
5-fluoro-1H-indole

Guidance literature:: In quinoline; for 0.2h; microwave;
DOI:10.1021/jo00072a052

Reference yield: 92.0%

: 56341-41-4
5-fluoroindol-2(3H)-one

: 399-52-0
5-fluoro-1H-indole

Guidance literature:: With bis(trimethylsilyl)amide yttrium(III); 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; In toluene; at 120 ℃; for 36h; Inert atmosphere;