3-Butoxybenzoyl chloride

Base Information

Chemical Name:3-Butoxybenzoyl chloride
CAS No.:89790-29-4
Molecular Formula:C11H13 Cl O2
Molecular Weight:212.676
Hs Code.:2918990090
DSSTox Substance ID:DTXSID10594162
Wikidata:Q82488918
Mol file:89790-29-4.mol

Synonyms:3-BUTOXYBENZOYL CHLORIDE;89790-29-4;3-Butoxy-benzoyl chloride;BENZOYL CHLORIDE, 3-BUTOXY-;SCHEMBL5202638;DTXSID10594162;BBL014172;MFCD11939565;STL196599;AKOS000114295;VS-04219;DB-286006

Suppliers and Price of 3-Butoxybenzoyl 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-Butoxy-benzoylchloride
100mg
$ 90.00

Rieke Metals
3-BUTOXY-BENZOYLCHLORIDE
1g
$ 809.00

Rieke Metals
3-BUTOXY-BENZOYLCHLORIDE
5g
$ 1943.00

Matrix Scientific
3-Butoxybenzoyl chloride
500mg
$ 237.00

Biosynth Carbosynth
3-Butoxybenzoyl chloride
5 g
$ 868.00

Biosynth Carbosynth
3-Butoxybenzoyl chloride
2 g
$ 434.00

Biosynth Carbosynth
3-Butoxybenzoyl chloride
1 g
$ 255.00

Biosynth Carbosynth
3-Butoxybenzoyl chloride
500 mg
$ 150.00

Biosynth Carbosynth
3-Butoxybenzoyl chloride
250 mg
$ 85.00

Total 5 raw suppliers

Chemical Property of 3-Butoxybenzoyl chloride

Chemical Property:

PSA：26.30000
LogP:3.24450
XLogP3:3.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:212.0604073
Heavy Atom Count:14
Complexity:182

Purity/Quality:

98%Min ^*data from raw suppliers

3-Butoxy-benzoylchloride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCOC1=CC=CC(=C1)C(=O)Cl

Technology Process of 3-Butoxybenzoyl chloride

There total 4 articles about 3-Butoxybenzoyl 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%

: 93351-38-3
3-butoxy-benzoic acid

: 89790-29-4
m-(n-butoxy)benzoyl chloride

Guidance literature:: 3-butoxy-benzoic acid; With N,N-dimethyl-formamide; In dichloromethane; at 0 ℃; for 0.0833333h;

With oxalyl dichloride; In dichloromethane; at 20 ℃; for 12h;
DOI:10.1021/jacs.0c13415

Reference yield:

: 7781-98-8
ethyl-3-hydroxybenzoate

: 89790-29-4
m-(n-butoxy)benzoyl chloride

Guidance literature:: Multi-step reaction with 3 steps

1: sodium ethylate; ethanol

2: ethanolic KOH-solution

3: phosphorus (V)-chloride

With potassium hydroxide; ethanol; phosphorus pentachloride; sodium ethanolate;
DOI:10.1021/ja01259a062

Reference yield:

: 178552-51-7
3-butoxy-benzoic acid ethyl ester

: 89790-29-4
m-(n-butoxy)benzoyl chloride

Guidance literature:: Multi-step reaction with 2 steps

1: ethanolic KOH-solution

2: phosphorus (V)-chloride

With potassium hydroxide; phosphorus pentachloride;
DOI:10.1021/ja01259a062