2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-

Base Information

• Chemical Name: 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-
• CAS No.: 636-01-1
• Molecular Formula: C9H8O4
• Molecular Weight: 180.16
• Hs Code.: 2918290000
• Wikidata: Q4596785,Q105136597
• Mol file: 636-01-1.mol

Synonyms:2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-;AKOS028111155;FT-0610383;Q4596785

Chemical Property of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-

Chemical Property:

• Vapor Pressure: 3.55E-09mmHg at 25°C
• Melting Point: 207 °C
• Refractive Index: 1.706
• Boiling Point: 457.8 °C at 760 mmHg
• PKA: 4.45±0.10(Predicted)
• Flash Point: 244.8 °C
• PSA: 77.76000
• Density: 1.478 g/cm³
• LogP: 1.19560
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 180.04225873
• Heavy Atom Count: 13
• Complexity: 212

Purity/Quality:

98% ^*data from raw suppliers

(2E)-3-(2,5-Dihydroxyphenyl)acrylicAcid ^*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=CC(=C(C=C1O)C=CC(=O)O)O

Technology Process of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-

There total 2 articles about 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)- 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:

o-Coumaric acid (614-60-8) → 2,5-dihydroxycinnamic acid (636-01-1)

Guidance literature:

With potassium peroxomonosulphate; Erhitzen des Reaktionsproduktes mit Salzsaeure;

Reference yield:

→ 2,5-dihydroxycinnamic acid (636-01-1)

Guidance literature:

6-Hydroxy-cumarin, alkal. wss. Acetonitril (30grad), Hydrolyse;

DOI:10.1021/ja00803a025

Reference yield:

2,5-dihydroxycinnamic acid (636-01-1) → 6-hydroxy-3,4-dihydrocoumarin (2669-94-5)

Guidance literature:

With sodium amalgam; Ansaeuern der Loesung;

upstream raw materials:

o-Coumaric acid

Downstream raw materials:

6-hydroxy-3,4-dihydrocoumarin

2,5-dimethoxycinnamic acid