Isoclavicin

Base Information

Chemical Name:Isoclavicin
CAS No.:484-91-3
Molecular Formula:C7H6O4
Molecular Weight:154.1201
Hs Code.:
NSC Number:407489,402276
UNII:CKH162OZMV
DSSTox Substance ID:DTXSID70197517
Nikkaji Number:J12.524E
Wikidata:Q27275503
Mol file:484-91-3.mol

Synonyms:isopatulin

Suppliers and Price of Isoclavicin

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 3 raw suppliers

Chemical Property of Isoclavicin

Chemical Property:

Vapor Pressure:3.82E-05mmHg at 25°C
Boiling Point:352.5°Cat760mmHg
Flash Point:162.6°C
PSA：52.60000
Density:1.44g/cm³
LogP:-0.21330
XLogP3:-0.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:154.02660867
Heavy Atom Count:11
Complexity:264

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1COC2=C(C1=O)COC2=O

Technology Process of Isoclavicin

There total 6 articles about Isoclavicin 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: 50.0%

: 3-((3-ethoxyprop-2-yn-1-yl)oxy)furan-2(5H)-one

: 484-91-3
isopatulin

Guidance literature:: With [bis(trifluoromethanesulfonyl)imidate](triphenylphosphine)gold(I); In 1,2-dichloro-ethane; at 20 ℃; for 1h;
DOI:10.1021/acs.orglett.5b03641

Reference yield:

: 412324-20-0
4-(3-methoxy-propionyl)-dihydro-furan-2,3-dione

: 484-91-3
isopatulin

Guidance literature:: With hydrogenchloride; ethyl acetate;

Reference yield:

: 855208-71-8
6-methoxy-2,4-dioxo-hexanoic acid methyl ester

: 484-91-3
isopatulin

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate; water / anschliessend Ansaeuern mit wss. Salzsaeure

2: hydrogen chloride; ethyl acetate

With hydrogenchloride; water; potassium carbonate; ethyl acetate;