3-(4-Isobutoxy-3-methoxyphenyl)acrylic acid

Base Information

• Chemical Name: 3-(4-Isobutoxy-3-methoxyphenyl)acrylic acid
• CAS No.: 744243-58-1
• Molecular Formula: C₁₄H₁₈O₄
• Molecular Weight: 250.295
• DSSTox Substance ID: DTXSID301199251
• Mol file: 744243-58-1.mol

Synonyms:3-(4-isobutoxy-3-methoxyphenyl)acrylic acid;DTXSID301199251;CID 3487928;3-[3-Methoxy-4-(2-methylpropoxy)phenyl]-2-propenoic acid

Chemical Property of 3-(4-Isobutoxy-3-methoxyphenyl)acrylic acid

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 250.12050905
• Heavy Atom Count: 18
• Complexity: 286

Purity/Quality:

99% ^*data from raw suppliers

(2E)-3-(4-ISOBUTOXY-3-METHOXYPHENYL)ACRYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)COC1=C(C=C(C=C1)C=CC(=O)O)OC

Technology Process of 3-(4-Isobutoxy-3-methoxyphenyl)acrylic acid

There total 6 articles about 3-(4-Isobutoxy-3-methoxyphenyl)acrylic acid 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: 55.0%

malonic acid (141-82-2) + 4-(2-methylpropyloxy)-3-methoxybenzaldehyde (66488-79-7) → (E)-3-(4-isobutoxy-3-methoxyphenyl)acrylic acid (744243-58-1) + 3-amino-3-(4-isobutoxy-3-methoxy-phenyl)-propionic acid (902745-25-9)

Guidance literature:

With ammonium acetate; In butan-1-ol; Heating;

DOI:10.1007/s11176-005-0377-9

Reference yield: 37.0%

→ (E)-3-(4-isobutoxy-3-methoxyphenyl)acrylic acid (744243-58-1)

Guidance literature:

With sodium hydroxide; In acetone; at 90 ℃; for 2h;

Reference yield:

(E)-methyl 3-(4-isobutoxy-3-methoxyphenyl)acrylate → (E)-3-(4-isobutoxy-3-methoxyphenyl)acrylic acid (744243-58-1)

Guidance literature:

With sodium hydroxide; In acetone; at 90 ℃; for 2h;

DOI:10.3390/pharmaceutics11110593

upstream raw materials:

malonic acid

4-(2-methylpropyloxy)-3-methoxybenzaldehyde

vanillin

(E)-3-(4-hydroxy-3-methoxyphenyl)acrylic acid

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