Oxepin

Base Information

Chemical Name:Oxepin
CAS No.:291-70-3
Molecular Formula:C6H6 O
Molecular Weight:94.1112
Hs Code.:
UNII:CVP5X85XX5
DSSTox Substance ID:DTXSID10183353
Nikkaji Number:J247.751C
Wikipedia:Oxepin
Wikidata:Q132416
Mol file:291-70-3.mol

Synonyms:Oxepene;Oxepenes;Oxepin;Oxepins

Suppliers and Price of Oxepin

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 2 raw suppliers

Chemical Property of Oxepin

Chemical Property:

Vapor Pressure:1.07mmHg at 25°C
Boiling Point:183.1°Cat760mmHg
Flash Point:56.1°C
PSA：9.23000
Density:0.989g/cm³
LogP:1.60020
XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:94.041864811
Heavy Atom Count:7
Complexity:106

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=COC=C1

Technology Process of Oxepin

There total 7 articles about Oxepin 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:

: 58774-33-7
3,4-dibromo-7-oxabicyclo[4.1.0]heptane

: 1488-25-1
benzene oxide

: 291-70-3
oxepin

Guidance literature:: With potassium tert-butylate; In diethyl ether; at 0 - 20 ℃; for 1.5h; Overall yield = 76 percent; Overall yield = 3.4 mmol;
DOI:10.1002/anie.202010452

Reference yield:

: 16151-91-0
3-Oxatetracyclo<3.2.0.0^2,7.0^4,6>heptan

: 1488-25-1
benzene oxide

: 291-70-3
oxepin

Guidance literature:: With aluminum oxide; In benzene; at 100 ℃; for 4h; Yield given. Yields of byproduct given. Title compound not separated from byproducts; bomb tube;

Reference yield:

: 58774-33-7,77123-27-4
(4RS,5RS)-1,2-epoxy-4,5-dibromocyclohexane

: 1488-25-1
benzene oxide

: 291-70-3
oxepin

Guidance literature:: With 1,8-diazabicyclo[5.4.0]undec-7-ene; In diethyl ether; for 24h; Yield given. Title compound not separated from byproducts; Ambient temperature;