3-bromo-5-nitro-1H-indole

Base Information

Chemical Name:3-bromo-5-nitro-1H-indole
CAS No.:525593-33-3
Molecular Formula:C8H5BrN2O2
Molecular Weight:241.044
Hs Code.:2933990090
European Community (EC) Number:860-871-5
DSSTox Substance ID:DTXSID60655590
Wikidata:Q72448621
Mol file:525593-33-3.mol

Synonyms:3-bromo-5-nitro-1H-indole;3-BROMO-5-NITROINDOLE;525593-33-3;1H-Indole, 3-bromo-5-nitro-;MFCD11110951;SCHEMBL981675;DTXSID60655590;LBTWTOYAMQQAKO-UHFFFAOYSA-N;AMY31726;AKOS009322817;CS-W007030;AC-30545;DS-15215;SY006253;FT-0740476;EN300-62801;A870960;Z382706826

Suppliers and Price of 3-bromo-5-nitro-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

TRC
3-Bromo-5-nitro-1h-indole
1g
$ 175.00

Crysdot
3-Bromo-5-nitroindole 97%
10g
$ 307.00

Crysdot
3-Bromo-5-nitroindole 97%
25g
$ 644.00

Chemenu
3-Bromo-5-nitro-1H-indole 95%+
25g
$ 608.00

Chemenu
3-Bromo-5-nitro-1H-indole 95%+
10g
$ 290.00

Chemenu
3-Bromo-5-nitro-1H-indole 95%+
5g
$ 190.00

Biosynth Carbosynth
3-Bromo-5-nitro-1H-indole
2 mg
$ 59.00

Biosynth Carbosynth
3-Bromo-5-nitro-1H-indole
5 mg
$ 117.00

Biosynth Carbosynth
3-Bromo-5-nitro-1H-indole
10 mg
$ 203.00

Biosynth Carbosynth
3-Bromo-5-nitro-1H-indole
25 mg
$ 405.00

Total 30 raw suppliers

Chemical Property of 3-bromo-5-nitro-1H-indole

Chemical Property:

Melting Point:191-194 °C
Boiling Point:417.64 °C at 760 mmHg
PKA:13.58±0.30(Predicted)
Flash Point:206.382 °C
PSA：61.61000
Density:1.856 g/cm³
LogP:3.36180
Storage Temp.:2-8°C
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:239.95344
Heavy Atom Count:13
Complexity:219

Purity/Quality:

99%, ^*data from raw suppliers

3-Bromo-5-nitro-1h-indole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC2=C(C=C1[N+](=O)[O-])C(=CN2)Br

Technology Process of 3-bromo-5-nitro-1H-indole

There total 2 articles about 3-bromo-5-nitro-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: 98.0%

: 6146-52-7
5-nitroindole

: 525593-33-3
3-bromo-5-nitro-1H-indole

Guidance literature:: With tetrabutylammomium bromide; copper(ll) bromide; In ethanol; at 45 ℃; regioselective reaction;
DOI:10.1080/00397911.2019.1598558

Reference yield: 45.0%

: 6146-52-7
5-nitroindole

: 685-87-0
Diethyl 2-bromomalonate

: 525593-33-3
3-bromo-5-nitro-1H-indole

Guidance literature:: With tris(bipyridine)ruthenium(II) dichloride hexahydrate; N,N-diphenyl-4-methoxyaniline; In N,N-dimethyl-formamide; at 20 ℃; for 48h; Inert atmosphere; Irradiation;
DOI:10.1055/s-0036-1588719

Reference yield: 9.0%

: 525593-33-3
3-bromo-5-nitro-1H-indole

: 98-80-6
phenylboronic acid

: 14182-35-5
5-nitro-3-phenyl-1H-indole 3ha

Guidance literature:: With sodium carbonate; triphenylphosphine; palladium diacetate; In 1,2-dimethoxyethane; water; for 8h; Heating / reflux;