1,1,1,3-Tetrachloro-4-methylpentane

Base Information

• Chemical Name: 1,1,1,3-Tetrachloro-4-methylpentane
• CAS No.: 62103-09-7
• Molecular Formula: C6H10Cl4
• Molecular Weight: 223.957
• Hs Code.: 2903199000
• European Community (EC) Number: 263-403-2
• DSSTox Substance ID: DTXSID10886473
• Nikkaji Number: J306.982F
• Mol file: 62103-09-7.mol

Synonyms:1,1,1,3-Tetrachloro-4-methylpentane;62103-09-7;Pentane, 1,1,1,3-tetrachloro-4-methyl-;EINECS 263-403-2;C6H10Cl4;C6-H10-Cl4;SCHEMBL11204404;DTXSID10886473

Chemical Property of 1,1,1,3-Tetrachloro-4-methylpentane

Chemical Property:

• Vapor Pressure: 0.299mmHg at 25°C
• Refractive Index: 1.476
• Boiling Point: 209 °C at 760 mmHg
• Flash Point: 72.3 °C
• PSA: 0.00000
• Density: 1.287 g/cm³
• LogP: 4.01010
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 223.950711
• Heavy Atom Count: 10
• Complexity: 94.4

Purity/Quality:

98%Min ^*data from raw suppliers

1,1,1,3-TETRACHLORO-4-METHYLPENTANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1,1,1,3-Tetrachloro-4-methylpentane

There total 4 articles about 1,1,1,3-Tetrachloro-4-methylpentane 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: 82.0%

tetrachloromethane (56-23-5) + 3-Methyl-1-butene (563-45-1) → 1,1,1,3-tetrachloro-4-methylpentane (62103-09-7)

Guidance literature:

With diethylamine; copper(l) chloride; at 85 ℃;

DOI:10.1007/BF00960326

Reference yield: 80.8%

3-Methyl-1-butene (563-45-1) → 1,1,1,3-tetrachloro-4-methylpentane (62103-09-7)

Guidance literature:

With dibenzoyl peroxide; In tetrachloromethane;

Reference yield:

1,1-dichloro-3-ethoxy-4-methyl-1-pentene (86136-80-3) → 1,1,1,3-tetrachloro-4-methylpentane (62103-09-7) + 1,1,3-trichloro-4-methyl-1-pentene (65696-60-8)

Guidance literature:

With hydrogenchloride; zinc(II) chloride; at 20 ℃; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1007/BF00957938

upstream raw materials:

tetrachloromethane

3-Methyl-1-butene

1,1-dichloro-3-ethoxy-4-methyl-1-pentene

Downstream raw materials:

1,1-dichloro-4-methyl-penta-1,3-diene