1-Chloro-3,5-diisopropylbenzene

Base Information

• Chemical Name: 1-Chloro-3,5-diisopropylbenzene
• CAS No.: 87945-06-0
• Molecular Formula: C₁₂H₁₇Cl
• Molecular Weight: 196.72
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID40236705
• Wikidata: Q72518582
• Mol file: 87945-06-0.mol

Synonyms:1-Chloro-3,5-diisopropylbenzene;87945-06-0;1-chloro-3,5-di(propan-2-yl)benzene;3,5-Diisopropyl-1-chlorobenzene;1-chloro-3,5-bis(propan-2-yl)benzene;SCHEMBL11574451;DTXSID40236705;BCP27192;AKOS005145956;AS-60634;CS-0061025;FT-0651472

Chemical Property of 1-Chloro-3,5-diisopropylbenzene

Chemical Property:

• Vapor Pressure: 0.161mmHg at 25°C
• Boiling Point: 221℃
• Flash Point: 106℃
• PSA: 0.00000
• Density: 0.976
• LogP: 4.58680
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 196.1018782
• Heavy Atom Count: 13
• Complexity: 135

Purity/Quality:

98%min ^*data from raw suppliers

1-Chloro-3,5-diisopropylbenzene 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-Chloro-3,5-diisopropylbenzene

There total 1 articles about 1-Chloro-3,5-diisopropylbenzene 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:

1-chloro-2,5-diisopropylbenzene (49841-53-4) → 1-chloro-3,5-diisopropylbenzene (87945-06-0)

Guidance literature:

at 298.2 ℃; Thermodynamic data; ΔH, ΔS;

DOI:10.1016/0021-9614(85)90118-1

upstream raw materials:

1-chloro-2,5-diisopropylbenzene

Refernces