2-Propenal, 3,3-dichloro-2-methyl-

Base Information

• Chemical Name: 2-Propenal, 3,3-dichloro-2-methyl-
• CAS No.: 1561-34-8
• Molecular Formula: C4H4 Cl2 O
• Molecular Weight: 138.98
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID10166045
• Mol file: 1561-34-8.mol

Synonyms:1561-34-8;2-Propenal, 3,3-dichloro-2-methyl-;3,3-dichloro-2-methylprop-2-enal;3,3-Dichloro-2-methyl-2-propenal;2-METHYL-3,3-DICHLOROACROLEIN;DTXSID10166045

Chemical Property of 2-Propenal, 3,3-dichloro-2-methyl-

Chemical Property:

• Vapor Pressure: 1.7mmHg at 25°C
• Boiling Point: 167.4°Cat760mmHg
• Flash Point: 61.8°C
• PSA: 17.07000
• Density: 1.288g/cm³
• LogP: 1.89440
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 137.9639201
• Heavy Atom Count: 7
• Complexity: 102

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)C=O

Technology Process of 2-Propenal, 3,3-dichloro-2-methyl-

There total 9 articles about 2-Propenal, 3,3-dichloro-2-methyl- 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:

3,3-dichloro-2-methyl-prop-2-en-1-ol (34454-81-4) → 3,3-Dichloro-2-methylpropenal (1561-34-8)

Guidance literature:

With nitric acid;

DOI:10.1021/ja01555a025

Reference yield:

3-ethoxy-1,1-dichloro-2-methyl-propene (75329-06-5) → 3,3-Dichloro-2-methylpropenal (1561-34-8)

Guidance literature:

With N-Bromosuccinimide; In 1,4-dioxane; water; at 30 - 40 ℃; for 2h; Yield given;

DOI:10.1055/s-1981-29500

Reference yield:

1,1-Dichloro-2-methyl-3-propoxy-propene (79476-48-5) → 3,3-Dichloro-2-methylpropenal (1561-34-8)

Guidance literature:

With N-Bromosuccinimide; In 1,4-dioxane; water; at 30 - 40 ℃; for 2h; Yield given;

DOI:10.1055/s-1981-29500

upstream raw materials:

3,3-dichloro-2-methyl-prop-2-en-1-ol

1,1,1-trichloro-2-methyl-3-nitro-propane

1,1,1-trichloro-2-methyl-2-propanol

3-ethoxy-1,1-dichloro-2-methyl-propene

Downstream raw materials:

-2-methyl-3-(4-chlorophenyl)prop-2-enoic acid

3,3-dichloro-2-methyl-acrylaldehyde di-p-tolyldithioacetal

3,3-dichloro-2-methyl-acrylaldehyde-[bis-(4-chloro-phenyl)-dithioacetal]

2-Methyl-3-phenyl-1,1-dichlor-propen-⁽¹⁾-ol-⁽³⁾