Octyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Base Information

• Chemical Name: Octyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
• CAS No.: 214779-01-8
• Molecular Formula: C₁₈H₂₆O₄
• Molecular Weight: 306.402
• DSSTox Substance ID: DTXSID00709586
• Wikidata: Q82644625,Q105205434
• Mol file: 214779-01-8.mol

Synonyms:214779-01-8;OCTYL 3-(4-HYDROXY-3-METHOXYPHENYL)PROP-2-ENOATE;SCHEMBL2793041;DTXSID00709586

Chemical Property of Octyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 306.18310931
• Heavy Atom Count: 22
• Complexity: 327

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC

Technology Process of Octyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

There total 2 articles about Octyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 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:

octanol (111-87-5) + methyl ferulate (22329-76-6,34298-89-0,2309-07-1) → octacyl ferulate (214779-01-8)

Guidance literature:

With Novozym₄₃₅; Amberlite IR-120H; In methanol; at 60 ℃; Molecular sieve; Enzymatic reaction;

DOI:10.1039/c3gc40899j

Reference yield:

3-(4-hydroxy-3-methoxyphenyl)acrylic acid (1135-24-6,537-98-4) + octanol (111-87-5) → octacyl ferulate (214779-01-8)

Guidance literature:

With tricapryl-methyl-ammonium trifluoroacetate; Candida antartica lipase B; at 80 ℃; for 384h; Concentration; Time; Kinetics; Molecular sieve; Enzymatic reaction;

DOI:10.1007/s11746-011-1989-3

upstream raw materials:

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

octanol

methyl ferulate