BENZOIC ACID, 2-CHLORO-5-HYDROXY-, ETHYL ESTER

Base Information

• Chemical Name: BENZOIC ACID, 2-CHLORO-5-HYDROXY-, ETHYL ESTER
• CAS No.: 39062-63-0
• Molecular Formula: C9H9ClO3
• Molecular Weight: 200.622
• Hs Code.: 2918290000
• Mol file: 39062-63-0.mol

Synonyms:Benzoic acid, 2-chloro-5-hydroxy-, ethyl ester;

Chemical Property of BENZOIC ACID, 2-CHLORO-5-HYDROXY-, ETHYL ESTER

Chemical Property:

• Vapor Pressure: 8.3E-05mmHg at 25°C
• Refractive Index: 1.554
• Boiling Point: 331 °C at 760 mmHg
• PKA: 8.75±0.18(Predicted)
• Flash Point: 154 °C
• PSA: 46.53000
• Density: 1.3 g/cm³
• LogP: 2.22230

Purity/Quality:

99% ^*data from raw suppliers

Ethyl2-chloro-5-hydroxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BENZOIC ACID, 2-CHLORO-5-HYDROXY-, ETHYL ESTER

There total 2 articles about BENZOIC ACID, 2-CHLORO-5-HYDROXY-, ETHYL ESTER 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:

ethanol (64-17-5) + 2-chloro-5-hydroxybenzoic acid (56961-30-9) → 2-chloro-5-hydroxybenzoic acid ethyl ester (39062-63-0)

Guidance literature:

In benzene;

DOI:10.1039/P19730000001

Reference yield:

→ 2-chloro-5-hydroxybenzoic acid ethyl ester (39062-63-0)

Guidance literature:

With thionyl chloride; at 60 ℃; for 18h;

Reference yield: 90.0%

Isobutyl bromide (78-77-3) + 2-chloro-5-hydroxybenzoic acid ethyl ester (39062-63-0) → ethyl 2-chloro-5-isobutoxybenzoate (1621681-46-6)

Guidance literature:

With caesium carbonate; In acetonitrile; Reflux;

upstream raw materials:

ethanol

2-chloro-5-hydroxybenzoic acid

Downstream raw materials:

5-(benzyloxy)-2-chlorobenzoic acid

2-[[3-(trifluoromethyl)phenyl]amino]-5-hydroxybenzoic acid

2-chloro-5-hydroxybenzoic acid ethyl ester

C₁₅H₁₀ClN₅O

Refernces

• 1、 -. "NOVEL PYRIDOPYRIMIDINONE COMPOUNDS FOR MODULATING THE CATALYTIC ACTIVITY OF HISTONE LYSINE DEMETHYLASES (KDMS)". Page/Page column 78-79. . Retrieved 2016/05/19.
• 2、 -. "4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes". Paragraph 0565-0568. . Retrieved 2014/03/21.