4-(4-Chlorophenyl)-1-butene

Base Information

• Chemical Name: 4-(4-Chlorophenyl)-1-butene
• CAS No.: 3047-24-3
• Molecular Formula: C10H11Cl
• Molecular Weight: 166.65
• Hs Code.: 2903999090
• European Community (EC) Number: 608-483-5
• DSSTox Substance ID: DTXSID30453368
• Nikkaji Number: J1.429.378G
• Wikidata: Q82274492
• Mol file: 3047-24-3.mol

Synonyms:4-(4-Chlorophenyl)-1-butene;3047-24-3;1-but-3-enyl-4-chlorobenzene;1-(But-3-en-1-yl)-4-chlorobenzene;4-p-chlorophenyl-1-butene;MFCD01319548;4-(But-3-en-1-yl)chlorobenzene;Benzene, 1-(3-butenyl)-4-chloro-;SCHEMBL4902643;4-(3-butenyl)-1-chlorobenzene;DTXSID30453368;KUJQWMSGSABUFJ-UHFFFAOYSA-N;1-(but-3-enyl)-4-chlorobenzene;1-chloro-4-(3-butenyl)-benzene;AKOS016016714;CS-0450746

Chemical Property of 4-(4-Chlorophenyl)-1-butene

Chemical Property:

• Vapor Pressure: 0.254mmHg at 25°C
• Refractive Index: 1.524
• Boiling Point: 212.278 °C at 760 mmHg
• Flash Point: 84.299 °C
• PSA: 0.00000
• Density: 1.027 g/cm³
• LogP: 3.45860
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 166.0549280
• Heavy Atom Count: 11
• Complexity: 112

Purity/Quality:

98%Min ^*data from raw suppliers

4-(But-3-en-1-yl)chlorobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCCC1=CC=C(C=C1)Cl

Technology Process of 4-(4-Chlorophenyl)-1-butene

There total 12 articles about 4-(4-Chlorophenyl)-1-butene 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%

4-chlorobenzyl bromide (622-95-7) + allylmagnesium bromide (1730-25-2) → 4-(p-chlorophenyl)-1-butene (3047-24-3)

Guidance literature:

In tetrahydrofuran; diethyl ether; at 0 - 20 ℃; for 2h; Inert atmosphere;

DOI:10.1039/c3cc46727a

Reference yield: 86.0%

allyl bromide (106-95-6) + 4-chlorobenzyl bromide (622-95-7) → 4-(p-chlorophenyl)-1-butene (3047-24-3)

Guidance literature:

With palladium diacetate; copper(II) acetate monohydrate; ammonium bromide; lithium chloride; In water; N,N-dimethyl-formamide; at 0 ℃; for 12h; Electrochemical reaction;

DOI:10.1021/acs.orglett.7b00473

Reference yield: 83.0%

4-chlorobenzyl bromide (622-95-7) + 3-chloroprop-1-ene (107-05-1) → 4-(p-chlorophenyl)-1-butene (3047-24-3)

Guidance literature:

With palladium diacetate; copper(II) acetate monohydrate; ammonium bromide; lithium chloride; In water; N,N-dimethyl-formamide; at 0 ℃; for 12h; Electrochemical reaction;

DOI:10.1021/acs.orglett.7b00473

upstream raw materials:

4-chlorobenzylmagnesium bromide

allyl bromide

1-bromo-4-butene

para-dichlorobenzene

Downstream raw materials:

1,2-Epoxy-4-(4-chlorophenyl)butane

trans-1-(but-2-en-1-yl)-4-chlorobenzene

4-(p-chlorophenyl)-1-butanol

1-[(E)-(but-1-en-1-yl)]-4-chlorobenzene

Refernces

• 1、 Fanourakis, Alexander,Paterson, Kieran J.,Phipps, Robert J.,Williams, Benjamin D.. "Enantioselective Intermolecular C-H Amination Directed by a Chiral Cation". supporting information. p. 10070 - 10076. Retrieved 2021/07/21.
• 2、 Meng, Qing-Yuan,Schirmer, Tobias E.,Katou, Kousuke,K?nig, Burkhard. "Controllable Isomerization of Alkenes by Dual Visible-Light-Cobalt Catalysis". supporting information. p. 5723 - 5728. Retrieved 2019/04/03.