4-chloro-5-fluoro-1H-indole

Base Information

Chemical Name:4-chloro-5-fluoro-1H-indole
CAS No.:169674-02-6
Molecular Formula:C₈H₅ClFN
Molecular Weight:169.586
Hs Code.:2933998090
DSSTox Substance ID:DTXSID90469344
Wikidata:Q72450803
Mol file:169674-02-6.mol

Synonyms:4-chloro-5-fluoro-1H-indole;169674-02-6;4-CHLORO-5-FLUOROINDOLE;MFCD12924664;SCHEMBL8959626;DTXSID90469344;TUYZSKJQXNCPLN-UHFFFAOYSA-N;AKOS022176147;MB12195;DS-12485;SY033207;A3745;CS-0311476;FT-0687477;F30325

Suppliers and Price of 4-chloro-5-fluoro-1H-indole

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

SynQuest Laboratories
4-Chloro-5-fluoro-1H-indole 97%
250 mg
$ 836.00

SynQuest Laboratories
4-Chloro-5-fluoro-1H-indole 97%
1 g
$ 927.00

SynQuest Laboratories
4-Chloro-5-fluoro-1H-indole 97%
100 mg
$ 472.00

Crysdot
4-Chloro-5-fluoro-1H-indole 97%
1g
$ 730.00

Chemenu
4-chloro-5-fluoro-1H-indole 95%+
1g
$ 574.00

Apolloscientific
4-Chloro-5-fluoro-1H-indole 97%
250mg
$ 522.00

Apolloscientific
4-Chloro-5-fluoro-1H-indole 97%
100mg
$ 295.00

Ambeed
4-Chloro-5-fluoro-1H-indole 97%
250mg
$ 177.00

Ambeed
4-Chloro-5-fluoro-1H-indole 97%
100mg
$ 111.00

Ambeed
4-Chloro-5-fluoro-1H-indole 97%
1g
$ 460.00

Total 15 raw suppliers

Chemical Property of 4-chloro-5-fluoro-1H-indole

Chemical Property:

Vapor Pressure:0.002mmHg at 25°C
Melting Point:21-22 °C(Solv: hexane (110-54-3))
Refractive Index:1.657
Boiling Point:299.774 °C at 760 mmHg
PKA:15.26±0.30(Predicted)
Flash Point:135.099 °C
PSA：15.79000
Density:1.437 g/cm³
LogP:2.96040
Storage Temp.:under inert gas (nitrogen or Argon) at 2–8 °C
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:169.0094550
Heavy Atom Count:11
Complexity:153

Purity/Quality:

97% ^*data from raw suppliers

4-Chloro-5-fluoro-1H-indole 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=C(C2=C1NC=C2)Cl)F

Technology Process of 4-chloro-5-fluoro-1H-indole

There total 12 articles about 4-chloro-5-fluoro-1H-indole 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: 94.0%

: 908600-95-3
4-chloro-5-fluoro-1-(triisopropylsilyl)indole

: 169674-02-6
4-chloro-5-fluoroindole

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 25 ℃;
DOI:10.1002/ejoc.200600118

Reference yield:

: 4-chloro-5-fluoro-1H-indole-2-carboxylic acid

: 169674-02-6
4-chloro-5-fluoroindole

Guidance literature:

Reference yield:

: 908600-86-2
5-fluoro-1-(triisopropylsilyl)-1H-indole

: 169674-02-6
4-chloro-5-fluoroindole

Guidance literature:: Multi-step reaction with 2 steps

1.1: 2,2,6,6-tetramethylpiperidine; N,N,N',N'-pentamethyldiethylenetriamine; BuLi / tetrahydrofuran; hexane / 6 h / -75 °C

1.2: 62 percent / 1,1,2-trichloro-1,2,2-trifluoroethane / tetrahydrofuran; hexane / -75 - 25 °C

2.1: 94 percent / tetrabutylammonium fluoride hydrate / tetrahydrofuran / 25 °C

With 2,2,6,6-tetramethyl-piperidine; n-butyllithium; N,N,N',N'',N'''-pentamethyldiethylenetriamine; tetrabutyl ammonium fluoride; In tetrahydrofuran; hexane;
DOI:10.1002/ejoc.200600118