3-Bromo-4-nitro-1H-indole

Base Information

Chemical Name:3-Bromo-4-nitro-1H-indole
CAS No.:126807-08-7
Molecular Formula:C8H5 Br N2 O2
Molecular Weight:241.044
Hs Code.:2933990090
DSSTox Substance ID:DTXSID80563209
Wikidata:Q82447587
Mol file:126807-08-7.mol

Synonyms:3-Bromo-4-nitroindole;126807-08-7;3-Bromo-4-nitro-1H-indole;1H-Indole, 3-bromo-4-nitro-;MFCD04973972;SCHEMBL3786029;DTXSID80563209;AKOS013575314;SB15297;CS-11127;SY006245;CS-0044460;A889362;3-(5-OXO-2-THIOXO-IMIDAZOLIDIN-4-YL)-PROPIONICACID

Suppliers and Price of 3-Bromo-4-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

Matrix Scientific
3-Bromo-4-nitro-1H-indole
25g
$ 2520.00

Matrix Scientific
3-Bromo-4-nitro-1H-indole
5g
$ 553.00

Matrix Scientific
3-Bromo-4-nitro-1H-indole
1g
$ 238.00

Crysdot
3-Bromo-4-nitro-1H-indole 95+%
5g
$ 330.00

Chemenu
3-Bromo-4-nitro-1H-indole 95%
5g
$ 311.00

Biosynth Carbosynth
3-Bromo-4-Nitro-1H-Indole
250 mg
$ 87.50

Biosynth Carbosynth
3-Bromo-4-Nitro-1H-Indole
500 mg
$ 140.00

Biosynth Carbosynth
3-Bromo-4-Nitro-1H-Indole
1 g
$ 348.60

Biosynth Carbosynth
3-Bromo-4-Nitro-1H-Indole
2 g
$ 557.80

Biosynth Carbosynth
3-Bromo-4-Nitro-1H-Indole
5 g
$ 892.40

Total 23 raw suppliers

Chemical Property of 3-Bromo-4-nitro-1H-indole

Chemical Property:

Melting Point:115-117 °C (decomp)
Refractive Index:1.747
Boiling Point:417.6±25.0 °C(Predicted)
PKA:13.10±0.30(Predicted)
PSA：61.61000
Density:1.855±0.06 g/cm3(Predicted)
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:

98% ^*data from raw suppliers

3-Bromo-4-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-4-nitro-1H-indole

There total 1 articles about 3-Bromo-4-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: 87.0%

: 4769-97-5
4-nitro-1H-indoIe

: 126807-08-7
3-bromo-4-nitro-1H-indole

Guidance literature:: With pyridine; pyridinium hydrobromide perbromide; at 0 ℃; for 0.5h;

Reference yield: 82.0%

: 126807-08-7
3-bromo-4-nitro-1H-indole

: 98-59-9
p-toluenesulfonyl chloride

: 1322744-50-2
3-bromo-4-nitro-1-(toluene-4-sulfonyl)-1H-indole

Guidance literature:: 3-bromo-4-nitro-1H-indole; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 0 ℃; for 0.166667h; Inert atmosphere;

p-toluenesulfonyl chloride; In N,N-dimethyl-formamide; mineral oil; at 0 ℃; for 2h;

Reference yield:

: 126807-08-7
3-bromo-4-nitro-1H-indole

: C₂₄H₂₇N₃O₈S

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydride / mineral oil; N,N-dimethyl-formamide / 0.17 h / 0 °C / Inert atmosphere

1.2: 2 h / 0 °C

2.1: chloro-trimethyl-silane; ethylene dibromide; zinc / N,N-dimethyl-formamide / 2.5 h / 20 °C

2.2: 4 h / 35 °C

With chloro-trimethyl-silane; sodium hydride; ethylene dibromide; zinc; In N,N-dimethyl-formamide; mineral oil;