3-Bromo-4-methoxybenzoyl chloride

Base Information

Chemical Name:3-Bromo-4-methoxybenzoyl chloride
CAS No.:81324-61-0
Molecular Formula:C8H6BrClO2
Molecular Weight:249.491
Hs Code.:2918990090
DSSTox Substance ID:DTXSID10377795
Wikidata:Q82167157
Mol file:81324-61-0.mol

Synonyms:3-bromo-4-methoxybenzoyl chloride;81324-61-0;3-bromo-4-methoxy-benzoyl Chloride;3-Bromo-4-methoxybenzoylchloride;SCHEMBL1287590;DTXSID10377795;UAAQIUYOLQEKLN-UHFFFAOYSA-N;MFCD02628379;STK087704;AKOS003226924;FS-6246

Suppliers and Price of 3-Bromo-4-methoxybenzoyl chloride

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-4-methoxybenzoylChloride
100mg
$ 165.00

Crysdot
3-Bromo-4-Methoxybenzoylchloride 95+%
1g
$ 445.00

CHESS?
CC000193:3-Bromo-4-methoxy-benzoylchloride 96
5 g
$ 600.00

CHESS?
CC000193:3-Bromo-4-methoxy-benzoylchloride 96
1 g
$ 234.00

Atlantic Research Chemicals
3-Bromo-4-methoxybenzoylchloride 95%
1gm:
$ 183.80

Alichem
3-Bromo-4-methoxybenzoylchloride
1g
$ 1490.00

Alichem
3-Bromo-4-methoxybenzoylchloride
500mg
$ 831.30

Alichem
3-Bromo-4-methoxybenzoylchloride
250mg
$ 475.20

Advanced Chemicals Intermediatesced Chemicals Intermediates
3-Bromo-4-methoxy-benzoylchloride 95%+
1g
$ 282.75

Acints
3-Bromo-4-methoxy-benzoylchloride 95%+
1g
$ 282.75

Total 9 raw suppliers

Chemical Property of 3-Bromo-4-methoxybenzoyl chloride

Chemical Property:

Boiling Point:316.8±27.0 °C(Predicted)
PSA：26.30000
Density:1.598±0.06 g/cm3(Predicted)
LogP:2.83670
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:247.92397
Heavy Atom Count:12
Complexity:174

Purity/Quality:

99%, ^*data from raw suppliers

3-Bromo-4-methoxybenzoylChloride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)C(=O)Cl)Br
Uses 3-Bromo-4-methoxybenzoyl Chloride is an intermediate in the synthesis of (3-Bromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)-methanone (B685230), which is an impurity of benzbromarone (B185200) and is currently being investigated as a potent human uric acid (U829200) transporter I inhibitor.

Technology Process of 3-Bromo-4-methoxybenzoyl chloride

There total 3 articles about 3-Bromo-4-methoxybenzoyl chloride 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: 100.0%

: 99-58-1
3-bromo-4-methoxybenzoic acid

: 81324-61-0
3-bromo-4-methoxy-benzoic acid chloride

Guidance literature:: With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; toluene; for 4h;

Reference yield:

: 100-09-4
4-methoxybenzoic acid

: 81324-61-0
3-bromo-4-methoxy-benzoic acid chloride

Guidance literature:: Multi-step reaction with 2 steps

1: bromine / tetrachloromethane / 24 h / 40 - 45 °C

2: thionyl chloride; N,N-dimethyl-formamide / 3 h / 80 - 90 °C

With thionyl chloride; bromine; N,N-dimethyl-formamide; In tetrachloromethane;
DOI:10.3390/molecules16064897

Reference yield:

: 35450-37-4
methyl 3-bromo-4-methoxybenzoate

: 81324-61-0
3-bromo-4-methoxy-benzoic acid chloride

Guidance literature:: Multi-step reaction with 2 steps

1: 77 percent / KOH / methanol; H₂O / 4 h / Heating

2: thionyl chloride / 1 h / Heating

With potassium hydroxide; thionyl chloride; In methanol; water;