1,1,3-Trichloro-2-methyl-1-propene

Base Information

• Chemical Name: 1,1,3-Trichloro-2-methyl-1-propene
• CAS No.: 31702-33-7
• Molecular Formula: C4H5 Cl3
• Molecular Weight: 159.443
• DSSTox Substance ID: DTXSID20185601
• Nikkaji Number: J112.919H
• Mol file: 31702-33-7.mol

Synonyms:1,1,3-TRICHLORO-2-METHYL-1-PROPENE;Propene, 1,1,3-trichloro-2-methyl-;31702-33-7;1-Propene, 1,1,3-trichloro-2-methyl-;SCHEMBL16823301;DTXSID20185601;GVFGURPOQVIHNM-UHFFFAOYSA-N;1,1,3-trichloro-2-methylpropene;1,1,3-trichloro-2-methyl-propene;AKOS006384433;1,1,3-Trichloro-2-methyl-1-propene #;InChI=1/C4H5Cl3/c1-3(2-5)4(6)7/h2H2,1H

Chemical Property of 1,1,3-Trichloro-2-methyl-1-propene

Chemical Property:

• Vapor Pressure: 3.8mmHg at 25°C
• Refractive Index: 1.4990
• Boiling Point: 156°Cat760mmHg
• Flash Point: 86.8°C
• PSA: 0.00000
• Density: 1.307g/cm³
• LogP: 2.93430
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 157.945683
• Heavy Atom Count: 7
• Complexity: 80.9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C(Cl)Cl)CCl

Technology Process of 1,1,3-Trichloro-2-methyl-1-propene

There total 24 articles about 1,1,3-Trichloro-2-methyl-1-propene 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:

1,2,2-trichloro-1-methylcyclopropane (130894-82-5) → 2,3-dichlorobuta-1,3-diene (1653-19-6) + 1,1,3-trichloro-2-methylprop-1-ene (31702-33-7) + 1,2,3-trichlorobut-2-ene (65087-02-7)

Guidance literature:

at 450 ℃; for 0.166667h; under 760.051 Torr; Flow reactor; Inert atmosphere;

DOI:10.1007/s11172-019-2567-3

Reference yield:

quinoline (91-22-5) + 1,1,1-trichloro-2-methyl-2-propanol (57-15-8) → 1,1,3-trichloro-2-methylprop-1-ene (31702-33-7) + 3,3,3-trichloro-2-methyl-1-propene (4749-27-3) + 2-chloroisobutyryl chloride (13222-26-9)

Guidance literature:

at 155 ℃;

Reference yield:

3,3,3-trichloro-2-methyl-1-propene (4749-27-3) → 1,1,3-trichloro-2-methylprop-1-ene (31702-33-7)

Guidance literature:

With hydrogenchloride; at 200 ℃;

upstream raw materials:

1,1,2,3-Tetrachlor-2-methylpropan

3,3,3-trichloro-2-methyl-1-propene

(E)-3-Ureido-but-2-enoic acid ethyl ester

ketene diethyl acetal

Downstream raw materials:

benzaldehyde-[O-(3,3-dichloro-2-methyl-allyl)-oxime ]

3-(4-bromo-phenyl)-1,1-dichloro-2-methyl-propene

(3,3-dichloro-2-methyl-allyl)-(4-nitro-phenyl)-ether

2-(3,3-dichloro-2-methyl-allyl)-4-methyl-phenol

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