2-Bromo-5-hydroxybenzonitrile

Base Information

Chemical Name:2-Bromo-5-hydroxybenzonitrile
CAS No.:189680-06-6
Molecular Formula:C7H4BrNO
Molecular Weight:198.019
Hs Code.:2926909090
European Community (EC) Number:807-535-6
DSSTox Substance ID:DTXSID90571471
Nikkaji Number:J876.373I
Wikidata:Q72456845
Mol file:189680-06-6.mol

Synonyms:2-BROMO-5-HYDROXYBENZONITRILE;189680-06-6;2-bromo-5-hydroxy-benzonitrile;Benzonitrile, 2-bromo-5-hydroxy-;MFCD08061922;4-BROMO-3-CYANOPHENOL;2-Bromo-5-hydroxybenzonitrle;SCHEMBL177459;DTXSID90571471;IXJNUEMHAJZKFW-UHFFFAOYSA-N;CL8152;AKOS005257266;AM84101;CS-W019014;FS-2757;MB05213;AC-26109;SY031508;A4189;EN300-343512;J-508382;Z1198175866

Suppliers and Price of 2-Bromo-5-hydroxybenzonitrile

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
2-Bromo-5-hydroxybenzonitrile
1g
$ 165.00

Matrix Scientific
2-Bromo-5-hydroxybenzonitrile 95+%
5g
$ 545.00

Matrix Scientific
2-Bromo-5-hydroxybenzonitrile 95+%
1g
$ 189.00

Matrix Scientific
2-Bromo-5-hydroxybenzonitrile 95+%
10g
$ 1036.00

Labseeker
2-Bromo-5-hydroxybenzonitrile 95
50g
$ 783.00

J&W Pharmlab
2-Bromo-5-hydroxy-benzonitrile 97%
1g
$ 18.00

Crysdot
2-Bromo-5-hydroxybenzonitrile 98%
25g
$ 201.00

Biosynth Carbosynth
2-Bromo-5-hydroxybenzonitrile
10 g
$ 120.00

Biosynth Carbosynth
2-Bromo-5-hydroxybenzonitrile
5 g
$ 70.00

Biosynth Carbosynth
2-Bromo-5-hydroxybenzonitrile
25 g
$ 220.00

Total 48 raw suppliers

Chemical Property of 2-Bromo-5-hydroxybenzonitrile

Chemical Property:

Vapor Pressure:0.000161mmHg at 25°C
Refractive Index:1.656
Boiling Point:321.212 °C at 760 mmHg
PKA:8.01±0.18(Predicted)
Flash Point:148.064 °C
PSA：44.02000
Density:1.794 g/cm³
LogP:2.02638
Storage Temp.:Inert atmosphere,Room Temperature
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:196.94763
Heavy Atom Count:10
Complexity:162

Purity/Quality:

99%, ^*data from raw suppliers

2-Bromo-5-hydroxybenzonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1O)C#N)Br
Uses 2-Bromo-5-hydroxybenzonitrile is a reagent used in the synthesis of various pharmaceutical goods.

Technology Process of 2-Bromo-5-hydroxybenzonitrile

There total 4 articles about 2-Bromo-5-hydroxybenzonitrile 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: 73.0%

: 873-62-1
m-cyanophenol

: 693232-06-3
2-bromo-3-hydroxybenzonitrile

: 189680-06-6
2-bromo-5-hydroxy-benzonitrile

Guidance literature:: With N-Bromosuccinimide; tetrafluoroboric acid; regioselective reaction;
DOI:10.3390/molecules19033401

Reference yield: 52.8%

: 873-62-1
m-cyanophenol

: 189680-06-6
2-bromo-5-hydroxy-benzonitrile

Guidance literature:: With N-Bromosuccinimide; boron trifluoride diethyl etherate; In acetonitrile; at -20 - 20 ℃; for 12h;
DOI:10.1021/acsmedchemlett.7b00476