3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol

Base Information

• Chemical Name: 3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol
• CAS No.: 103305-31-3
• Molecular Formula: C10H11ClO
• Molecular Weight: 182.65
• DSSTox Substance ID: DTXSID90708821
• Mol file: 103305-31-3.mol

Synonyms:103305-31-3;3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol;DTXSID90708821;AKOS017888324

Chemical Property of 3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 182.0498427
• Heavy Atom Count: 12
• Complexity: 157

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC1=CC=C(C=C1)Cl)CO

Technology Process of 3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol

There total 10 articles about 3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol 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: 98.0%

-2-methyl-3-(4-chlorophenyl)prop-2-enoic acid (1202-60-4,66482-40-4,14328-88-2) → (E)-3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol (103305-31-3)

Guidance literature:

With lithium aluminium tetrahydride; aluminium trichloride; In diethyl ether;

DOI:10.1002/anie.200601855

Reference yield: 90.0%

3-(4-chlorophenyl)-2-methylpropenal (24654-54-4,51791-27-6) → (E)-3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol (103305-31-3)

Guidance literature:

With methanol; sodium tetrahydroborate; cerium(III) chloride heptahydrate; for 0.0833333h; Inert atmosphere;

DOI:10.1002/ejoc.201901435

Reference yield: 73.0%

methyl 3-acetoxy-3-(4-chlorophenyl)-2-methylenepropanoate (131469-72-2) → (E)-3-(4-Chlorophenyl)-2-methylprop-2-en-1-ol (103305-31-3)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at -78 ℃; for 1h;

DOI:10.1039/c39920000955

upstream raw materials:

methyl 3-acetoxy-3-(4-chlorophenyl)-2-methylenepropanoate

3-(4-chlorophenyl)-2-methylpropenal

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

4-chlorobenzaldehyde

Downstream raw materials:

(2S,3S)-3-(4-Chloro-phenyl)-2,4-dimethyl-pent-4-enoic acid ethyl ester

(2R,3S)-3-(4-Chloro-phenyl)-2,4-dimethyl-pent-4-enoic acid ethyl ester