3-Chlorobenzoate

Base Information

Chemical Name:3-Chlorobenzoate
CAS No.:16887-60-8
Molecular Formula:C7H4 Cl O2
Molecular Weight:155.561
Hs Code.:
DSSTox Substance ID:DTXSID601302627
Nikkaji Number:J1.389.649F
Wikidata:Q27109272
Mol file:16887-60-8.mol

Synonyms:3-chlorobenzoate;3-chlorobenzoic acid;m-chlorobenzoic acid;meta-chlorobenzoate

Suppliers and Price of 3-Chlorobenzoate

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

Total 0 raw suppliers

Chemical Property of 3-Chlorobenzoate

Chemical Property:

PSA：40.13000
LogP:0.70350
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:154.9899821
Heavy Atom Count:10
Complexity:130

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)Cl)C(=O)[O-]

Technology Process of 3-Chlorobenzoate

There total 2 articles about 3-Chlorobenzoate 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:

: 535-80-8
3-chlorobenzoate

: 16887-60-8
m-chlorobenzoate anion

Guidance literature:: With cetyltrimethylammonium bromide; In water; at 30 ℃; Rate constant; protolysis studied by the ultrasonic absorption method; pK_a; the volume change of the reaction;
DOI:10.1039/ft9949000869

Reference yield:

: 37156-42-6
4-nitrophenyl 3-chlorobenzoate

: 3229-70-7,42428-36-4
phenolate

: 41998-17-8
phenyl 3-chlorobenzoate

: 14609-74-6
p-nitrophenolate

: 16887-60-8
m-chlorobenzoate anion

Guidance literature:: With KHCO₃ buffer; potassium chloride; potassium carbonate; In water; acetonitrile; at 25 ℃; pH=9.97; Kinetics;

Reference yield: 95.0%

: 16887-60-8
m-chlorobenzoate anion

: 766-76-7
benzoate

Guidance literature:: With ruthenium(II) tris(4,4'-dimethyl-2,2'-bipyridine); sodium dodecyl-sulfate; ascorbate; In water; for 14h; UV-irradiation;
DOI:10.1002/chem.201801955