3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one

Base Information

Chemical Name:3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one
CAS No.:69538-64-3
Molecular Formula:C16H11 Cl O3
Molecular Weight:286.715
Hs Code.:
NSC Number:159088
Nikkaji Number:J1.832.282J
ChEMBL ID:CHEMBL227747

Synonyms:3-(1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one;(E)-3-(1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one;69538-64-3;NSC159088;CHEMBL227747;MFCD00022994;NSC-159088;3-(1,3-Benzodioxole-5-yl)-1-(4-chlorophenyl)-2-propene-1-one;2-Propen-1-one, 3-(1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-, (2E)-;934022-22-7

Suppliers and Price of 3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one

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 6 raw suppliers

Chemical Property of 3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one

Chemical Property:

Vapor Pressure:3.26E-08mmHg at 25°C
Boiling Point:447.8°Cat760mmHg
Flash Point:184.9°C
Density:1.346g/cm³
XLogP3:4.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:286.0396719
Heavy Atom Count:20
Complexity:374

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1OC2=C(O1)C=C(C=C2)C=CC(=O)C3=CC=C(C=C3)Cl
Isomeric SMILES:C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)C3=CC=C(C=C3)Cl

Technology Process of 3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one

There total 6 articles about 3-(1,3-Benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one 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: 95.0%

: 120-57-0,30024-74-9
piperonal

: 99-91-2
para-chloroacetophenone

: 69538-64-3
(E)-3-(benzo[d][1,3]dioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one

Guidance literature:: With sodium hydroxide; In neat (no solvent); at 20 ℃; for 0.0833333 - 0.116667h; Milling; Green chemistry;
DOI:10.2174/1570180815666181016155934

Reference yield:

: 120-57-0,30024-74-9
piperonal

: 99-91-2
para-chloroacetophenone

: 69538-64-3
3-benzo[1,3]dioxol-5-yl-1-(4-chloro-phenyl)-propenone

Guidance literature:: With sodium hydroxide; In ethanol; Reflux;
DOI:10.1002/ardp.201100170

Reference yield:

: 139-85-5
3,4-dihydroxybenzaldehyde

: 69538-64-3
3-benzo[1,3]dioxol-5-yl-1-(4-chloro-phenyl)-propenone

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 24 h / Reflux

2: potassium hydroxide / ethanol; water / 20 °C

With potassium carbonate; potassium hydroxide; In ethanol; water; acetonitrile;
DOI:10.1016/j.bmc.2012.11.020