2,3,5-Trifluorocinnamic acid

Base Information

• Chemical Name: 2,3,5-Trifluorocinnamic acid
• CAS No.: 237761-79-4
• Molecular Formula: C₉H₅F₃O₂
• Molecular Weight: 202.133
• Hs Code.: 2916399090
• European Community (EC) Number: 671-770-9
• DSSTox Substance ID: DTXSID00420764
• Wikidata: Q76310705
• Mol file: 237761-79-4.mol

Synonyms:2,3,5-Trifluorocinnamic acid;237761-79-4;1384157-92-9;(E)-3-(2,3,5-trifluorophenyl)prop-2-enoic acid;(2E)-3-(2,3,5-trifluorophenyl)prop-2-enoic acid;(E)-3-(2,3,5-trifluorophenyl)acrylic acid;3-(2,3,5-trifluorophenyl)acrylic acid;SCHEMBL586064;DTXSID00420764;MFCD00083544;AKOS015854256;JS-4129;3-(2,3,5-Trifluorophenyl)-2-propenoic acid

Chemical Property of 2,3,5-Trifluorocinnamic acid

Chemical Property:

• Vapor Pressure: 0.00325mmHg at 25°C
• Boiling Point: 271oC at 760 mmHg
• PKA: 4.01±0.11(Predicted)
• Flash Point: 117.7oC
• PSA: 37.30000
• Density: 1.468g/cm3
• LogP: 2.20170
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 202.02416388
• Heavy Atom Count: 14
• Complexity: 242

Purity/Quality:

98%min ^*data from raw suppliers

2,3,5-TrifluorocinnamicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1C=CC(=O)O)F)F)F
• Isomeric SMILES: C1=C(C=C(C(=C1/C=C/C(=O)O)F)F)F

Technology Process of 2,3,5-Trifluorocinnamic acid

There total 1 articles about 2,3,5-Trifluorocinnamic 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: 68.0%

→ 3-(2,3,5-trifluorophenyl)acrylic acid (237761-79-4)

Guidance literature:

Refernces