Isopropenyl benzoate

Base Information

Chemical Name:Isopropenyl benzoate
CAS No.:13893-90-8
Molecular Formula:C10H10O2
Molecular Weight:162.188
Hs Code.:
UNII:GV67C833ES
Nikkaji Number:J1.316.248D
Mol file:13893-90-8.mol

Synonyms:isopropenyl benzoate;2-Benzoyloxypropene;1-Methylvinyl benzoate;1-Propen-2-ol, 2-benzoate;SCHEMBL140863;GV67C833ES

Suppliers and Price of Isopropenyl benzoate

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 1 raw suppliers

Chemical Property of Isopropenyl benzoate

Chemical Property:

PSA：57.53000
LogP:2.46280
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:162.068079557
Heavy Atom Count:12
Complexity:178

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=C)OC(=O)C1=CC=CC=C1

Technology Process of Isopropenyl benzoate

There total 7 articles about Isopropenyl benzoate 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: 86.0%

: 943025-68-1
2,4,6-tri(prop-1-en-2-yl)-1,3,5,2,4,6-trioxatriborinane-pyridine complex

: 65-85-0,8013-63-6
benzoic acid

: 13893-90-8
benzoic acid isopropenyl ester

Guidance literature:: With N,N'-diethylurea; copper(II) bis(trifluoromethanesulfonate); triethylamine; In tetrahydrofuran; at 50 ℃; for 16h;
DOI:10.1002/adsc.201800914

Reference yield: 8.0%

: 2206-94-2
1-acetoxy-1-phenylethene

: 13893-90-8
benzoic acid isopropenyl ester

: 98-86-2
acetophenone

: 65-85-0,8013-63-6
benzoic acid

: 93-91-4
1-phenylbutan-1,3-dione

Guidance literature:: In hexane; Product distribution; Irradiation;
DOI:10.1016/0040-4039(80)80218-8

Reference yield:

: 65-85-0,8013-63-6
benzoic acid

: 74-99-7
prop-1-yne

: 13893-90-8
benzoic acid isopropenyl ester

: (Z)-benzoic acid propenyl ester

Guidance literature:: With trifuran-2-yl-phosphane; sodium carbonate; [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; In toluene; at 50 ℃; for 16h; Title compound not separated from byproducts.;
DOI:10.1039/b211277a