3-Ketocarbofuran

Base Information

Chemical Name:3-Ketocarbofuran
CAS No.:16709-30-1
Molecular Formula:C12H13 N O4
Molecular Weight:235.24
Hs Code.:2932999099
European Community (EC) Number:622-556-9
DSSTox Substance ID:DTXSID10168226
Nikkaji Number:J351.189H
Wikidata:Q83037776
Metabolomics Workbench ID:45734
Mol file:16709-30-1.mol

Synonyms:3-ketocarbofuran

Suppliers and Price of 3-Ketocarbofuran

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

Usbiological
3-Ketocarbofuran
100mg
$ 460.00

TRC
3-Ketocarbofuran
1g
$ 1260.00

TRC
3-Ketocarbofuran
100mg
$ 160.00

Sigma-Aldrich
Carbofuran-3-keto PESTANAL?, analytical standard
10 mg
$ 165.00

Sigma-Aldrich
Carbofuran-3-keto PESTANAL
10mg-r
$ 160.00

Medical Isotopes, Inc.
3-Ketocarbofuran
1 g
$ 2200.00

Crysdot
2,2-Dimethyl-3-oxo-2,3-dihydrobenzofuran-7-ylmethylcarbamate 95+%
1g
$ 1786.00

American Custom Chemicals Corporation
3-KETOCARBOFURAN 95.00%
5MG
$ 496.61

Total 8 raw suppliers

Chemical Property of 3-Ketocarbofuran

Chemical Property:

Vapor Pressure:1.96E-05mmHg at 25°C
Melting Point:175-185℃
Boiling Point:362.2°C at 760 mmHg
PKA:11.92±0.46(Predicted)
Flash Point:>100℃
PSA：64.63000
Density:1.232g/cm³
LogP:2.14940
Storage Temp.:−20°C
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:235.08445790
Heavy Atom Count:17
Complexity:339

Purity/Quality:

97% ^*data from raw suppliers

3-Ketocarbofuran ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(=O)C2=C(O1)C(=CC=C2)OC(=O)NC)C

Technology Process of 3-Ketocarbofuran

There total 3 articles about 3-Ketocarbofuran 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: 65.0%

: 1563-66-2
2,3-dihydro-2,2-dimethyl-7-benzofuranol methylcarbamate

: 16709-30-1
2,3-dihydro-3-oxo-2,2-dimethylbenzofuran-7-yl methylcarbamate

Guidance literature:: With chromium(VI) oxide; acetic acid; at 25 - 30 ℃; for 16h;
DOI:10.1021/jf980347+

Reference yield:

: 55285-14-8
carbosulfan

: 16655-82-6
3-Hydroxycarbofuran

: 1563-38-8
2,3-dihydro-2,2-dimethylbenzofuran-7-ol

: 1563-66-2
2,3-dihydro-2,2-dimethyl-7-benzofuranol methylcarbamate

: 17781-16-7
2,3-dihydro-3-oxo-2,2-dimethylbenzofuran-7-ol

: 16709-30-1
2,3-dihydro-3-oxo-2,2-dimethylbenzofuran-7-yl methylcarbamate

: 1260117-81-4
C₂₀H₃₂N₂O₄S

: 111-92-2
dibutylamine

: 17781-15-6
2,3-dihydro-3-hydroxy-2,2-dimethylbenzofuran-7-ol

Guidance literature:: With liver microsomal protein; NADPH; In dimethyl sulfoxide; at 37 ℃; pH=7.4; Reagent/catalyst; Kinetics; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.cbi.2010.03.024