tert-butyl 5-fluoro-1H-indole-1-carboxylate

Base Information

Chemical Name:tert-butyl 5-fluoro-1H-indole-1-carboxylate
CAS No.:129822-47-5
Molecular Formula:C13H14FNO2
Molecular Weight:235.25400
Hs Code.:
DSSTox Substance ID:DTXSID10563252
Nikkaji Number:J416.464D
Wikidata:Q82447640
Mol file:129822-47-5.mol

Synonyms:129822-47-5;tert-butyl 5-fluoro-1H-indole-1-carboxylate;TERT-BUTYL 5-FLUOROINDOLE-1-CARBOXYLATE;MFCD09870066;1-Boc-5-fluoro-1H-indole;1-(tert-Butoxycarbonyl)-5-fluoroindole;SCHEMBL819797;DTXSID10563252;PCZRVRIBJPHEBB-UHFFFAOYSA-N;1H-Indole-1-carboxylic acid, 5-fluoro-, 1,1-dimethylethyl ester;AKOS015841203;5-Fluoro-1-(tert-butyloxycarbonyl)indole;AS-43903;SY235830;t-Butyl 5-fluoro-1H-indole-1-carboxylate;tert-butyl5-fluoro-1H-indole-1-carboxylate;tert-butyl 5-fluoro-1H-indole-1 -carboxylate;A805979;tert-butyl 5-fluoroindole-1-carboxylate

Suppliers and Price of tert-butyl 5-fluoro-1H-indole-1-carboxylate

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

American Custom Chemicals Corporation
5-FLUORO-N-(BOC)INDOLE 95.00%
5MG
$ 499.22

Alichem
Tert-butyl5-fluoro-1H-indole-1-carboxylate
1g
$ 321.90

Alichem
Tert-butyl5-fluoro-1H-indole-1-carboxylate
5g
$ 860.31

AK Scientific
Tert-butyl5-fluoro-1H-indole-1-carboxylate
5g
$ 998.00

Total 7 raw suppliers

Chemical Property of tert-butyl 5-fluoro-1H-indole-1-carboxylate

Chemical Property:

Vapor Pressure:0.000282mmHg at 25°C
Boiling Point:322.3oC at 760 mmHg
Flash Point:148.7oC
PSA：31.23000
Density:1.14g/cm3
LogP:3.56360
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:235.10085685
Heavy Atom Count:17
Complexity:300

Purity/Quality:

97% ^*data from raw suppliers

5-FLUORO-N-(BOC)INDOLE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)F

Technology Process of tert-butyl 5-fluoro-1H-indole-1-carboxylate

There total 15 articles about tert-butyl 5-fluoro-1H-indole-1-carboxylate 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: 99.57%

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

: 24424-99-5
di-tert-butyl dicarbonate

: 129822-47-5
tert‐butyl 5‐fluoroindole‐1‐carboxylate

Guidance literature:: In dichloromethane; at 10 - 15 ℃; for 12h;

Reference yield: 97.0%

: 317830-84-5
(1-(tert-butoxycarbonyl)-1H-indol-5-yl)boronic acid

: 129822-47-5
tert‐butyl 5‐fluoroindole‐1‐carboxylate

Guidance literature:: (1-(tert-butoxycarbonyl)-1H-indol-5-yl)boronic acid; With sodium hydroxide; In methanol; at 23 ℃; for 0.25h;

With silver trifluoromethanesulfonate; In methanol; at 0 ℃; for 0.5h;

With Selectfluor; In [⁽²⁾H₆]acetone; for 1h; Molecular sieve;