(E)-3-(2-(Trifluoromethoxy)phenyl)acrylic acid

Base Information

• Chemical Name: (E)-3-(2-(Trifluoromethoxy)phenyl)acrylic acid
• CAS No.: 399579-92-1
• Molecular Formula: C10H7F3O3
• Molecular Weight: 232.15600
• Hs Code.: 2918999090
• European Community (EC) Number: 879-323-1
• Mol file: 399579-92-1.mol

Synonyms:3-(2-(Trifluoromethoxy)phenyl)acrylic acid;(E)-3-(2-(TRIFLUOROMETHOXY)PHENYL)ACRYLIC ACID;399580-48-4;399579-92-1;2-(Trifluoromethoxy)cinnamic acid;trans-2-(Trifluoromethoxy)cinnamic acid;(2E)-3-[2-(trifluoromethoxy)phenyl]prop-2-enoic acid;(E)-3-[2-(trifluoromethoxy)phenyl]prop-2-enoic acid;MFCD06205273;3-[2-(trifluoromethoxy)phenyl]prop-2-enoic acid;3-(2-Trifluoromethoxy-phenyl)-acrylic acid;SCHEMBL1536410;RTCUAUKXVCMIBS-AATRIKPKSA-N;2-Propenoic acid, 3-[2-(trifluoromethoxy)phenyl]-, (2E)-;ZQA57992;AKOS000142734;PS-7694;BL002687;CS-0084340;EN300-35632;D74498;EN300-344067;J-501867;(E)-3-(2-(TRIFLUOROMETHOXY)PHENYL)ACRYLICACID;Z228584368

Chemical Property of (E)-3-(2-(Trifluoromethoxy)phenyl)acrylic acid

Chemical Property:

• PSA: 46.53000
• LogP: 2.68300
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 232.03472857
• Heavy Atom Count: 16
• Complexity: 273

Purity/Quality:

trans-2-(Trifluoromethoxy)cinnamic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C=CC(=O)O)OC(F)(F)F
• Isomeric SMILES: C1=CC=C(C(=C1)/C=C/C(=O)O)OC(F)(F)F

Technology Process of (E)-3-(2-(Trifluoromethoxy)phenyl)acrylic acid

There total 1 articles about (E)-3-(2-(Trifluoromethoxy)phenyl)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:

malonic acid (141-82-2) + C10H7F3O2 → 2-trifluormethoxycinnamic acid (399579-92-1,399580-48-4)

Guidance literature:

With piperidine; pyridine;

DOI:10.1002/cbdv.202100809

Reference yield:

2-trifluormethoxycinnamic acid (399579-92-1,399580-48-4) → C10H6ClF3O2

Guidance literature:

With oxalyl dichloride; In dichloromethane;

DOI:10.1002/cbdv.202100809

Reference yield:

2-trifluormethoxycinnamic acid (399579-92-1,399580-48-4) → C16H13F3N2O5

Guidance literature:

Multi-step reaction with 2 steps

1: oxalyl dichloride / dichloromethane

2: pyridine / dichloromethane

With pyridine; oxalyl dichloride; In dichloromethane;

DOI:10.1002/cbdv.202100809

upstream raw materials:

malonic acid

Refernces