1-Chloropent-4-en-2-one

Base Information

Chemical Name:1-Chloropent-4-en-2-one
CAS No.:100636-38-2
Molecular Formula:C5H7ClO
Molecular Weight:118.563
Hs Code.:
DSSTox Substance ID:DTXSID10541136
Nikkaji Number:J2.123.571G
Wikidata:Q82417383
Mol file:100636-38-2.mol

Synonyms:1-Chloropent-4-en-2-one;100636-38-2;SCHEMBL3055639;DTXSID10541136;AKOS006387399

Suppliers and Price of 1-Chloropent-4-en-2-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
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price

Total 0 raw suppliers

Chemical Property of 1-Chloropent-4-en-2-one

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:118.0185425
Heavy Atom Count:7
Complexity:78.1

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC(=O)CCl

Technology Process of 1-Chloropent-4-en-2-one

There total 2 articles about 1-Chloropent-4-en-2-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:

: 783340-76-1
cis-3-allyl-3,5-bis(chloromethyl)-5-methyl-1,2,4-trioxolane

: 100636-38-2
1-Chloro-4-penten-2-one

: 78-95-5
chloroacetone

Guidance literature:: With triphenylphosphine; In chloroform-d1; at 50 ℃; for 1.5h; Title compound not separated from byproducts.;
DOI:10.1002/ejoc.200400167

Reference yield:

: 783340-76-1
trans-3-allyl-3,5-bis(chloromethyl)-5-methyl-1,2,4-trioxolane

: 100636-38-2
1-Chloro-4-penten-2-one

: 78-95-5
chloroacetone

Guidance literature:: With triphenylphosphine; In chloroform-d1; at 50 ℃; for 1.5h; Title compound not separated from byproducts.;
DOI:10.1002/ejoc.200400167

Reference yield:

: 100636-38-2
1-Chloro-4-penten-2-one

: 138568-64-6
2-<4-(4-Allylthiazol-2-yl)phenyl>propionic Acid

Guidance literature:: Multi-step reaction with 4 steps

1: Br₂ / CH₂Cl₂ / 0.5 h / -60 °C

2: 100 percent / benzene / Heating

3: Zn, TiCl₄ / tetrahydrofuran

4: 76 percent / 1 N aq. NaOH / ethanol / Heating

With sodium hydroxide; bromine; titanium tetrachloride; zinc; In tetrahydrofuran; ethanol; dichloromethane; benzene;
DOI:10.1248/cpb.39.2323