4-METHOXYBENZOIC ACID SODIUM SALT

Base Information

• Chemical Name: 4-METHOXYBENZOIC ACID SODIUM SALT
• CAS No.: 536-45-8
• Molecular Formula: C8H8 O3 . Na
• Molecular Weight: 174.132
• Hs Code.: 2918990090
• Mol file: 536-45-8.mol

Synonyms:Benzoicacid, 4-methoxy-, sodium salt (9CI); p-Anisic acid, sodium salt (8CI);4-Methoxybenzoic acid sodium salt; Sodium 4-anisate; Sodium 4-methoxybenzoate;Sodium p-anisate; Sodium p-anisoate; Sodium p-methoxybenzoate; p-Methoxybenzoicacid sodium salt

Chemical Property of 4-METHOXYBENZOIC ACID SODIUM SALT

Chemical Property:

• Vapor Pressure: 0.00206mmHg at 25°C
• Boiling Point: 211.6°Cat760mmHg
• PKA: 4.42[at 20 ℃]
• Flash Point: 84.2°C
• PSA: 49.36000
• Density: 0.94g/cm³
• LogP: 0.05870
• Storage Temp.: Store below +30°C.
• Water Solubility.: 135g/L at 20℃
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 175.03711339
• Heavy Atom Count: 12
• Complexity: 136

Purity/Quality:

99.9% ^*data from raw suppliers

Sodium4-Methoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(=O)O.[Na]

Technology Process of 4-METHOXYBENZOIC ACID SODIUM SALT

There total 12 articles about 4-METHOXYBENZOIC ACID SODIUM SALT 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: 80.0%

4-Methoxybenzyl alcohol (105-13-5) → sodium anisate (536-45-8)

Guidance literature:

With sodium hydroxide; palladium on activated charcoal; In diethylene glycol dimethyl ether; at 160 ℃;

Reference yield:

4-methoxybenzoic acid (100-09-4) + 4-nitrophenol sodium salt (824-78-2) → 4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + sodium anisate (536-45-8)

Guidance literature:

With 1-butyl-2,3-dimethylimidazolium bis-(trifluoromethanesulfonyl)amide; In methanol; at 24.84 ℃; Reagent/catalyst; Equilibrium constant;

DOI:10.1021/jo100914p

Reference yield:

4-methoxy-benzaldehyde (123-11-5) → sodium anisate (536-45-8)

Guidance literature:

With sodium hydroxide; sodium periodate; ruthenium trichloride; In water; at 35 ℃; Kinetics; Mechanism; Thermodynamic data; other temperatures; dependence on the concentrations of substrate, base; ΔE(excit.), ΔH(excit.), ΔS(excit.);

upstream raw materials:

1-(4-methoxy-benzoyl)-aziridine

p-methoxyphenacyl acetate

sodium methylate

methyl 4-methoxybenzoate

Downstream raw materials:

trifluoromethan

difluoromethyl 4-methoxybenzoate

C₃₁H₂₉N₃O₄*C₈H₈O₃

4-methoxybenzoyl bromide

Refernces

• 1、 D'Anna, Francesca,Marullo, Salvatore,Vitale, Paola,Noto, Renato. "Electronic and steric effects: How do they work in ionic liquids? the case of benzoic acid dissociation". experimental part. p. 4828 - 4834. Retrieved 2010/10/04.
• 2、 Slebocka-Tilk, H.,Brown, R. S.. "Effect of Distortion on the Hydrolytic Reactivity of Amides. 2. N-Pyramidalization: Decomposition of N-Benzoylaziridines in Aqueous Media". . p. 805 - 808. Retrieved 2007/10/02.