Methyl 2-amino-5-chlorobenzoate

Base Information

• Chemical Name: Methyl 2-amino-5-chlorobenzoate
• CAS No.: 5202-89-1
• Molecular Formula: C8H8ClNO2
• Molecular Weight: 185.61
• Hs Code.: 29224999
• European Community (EC) Number: 225-992-4
• DSSTox Substance ID: DTXSID90199992
• Nikkaji Number: J80.974H
• Wikidata: Q72489134
• Mol file: 5202-89-1.mol

Synonyms:Methyl 2-amino-5-chlorobenzoate;5202-89-1;Methyl 5-chloroanthranilate;Methyl2-amino-5-chlorobenzoate;Benzoic acid, 2-amino-5-chloro-, methyl ester;2-Amino-5-chlorobenzoic Acid Methyl Ester;5-Chloroanthranilic Acid Methyl Ester;Anthranilic acid, 5-chloro-, methyl ester;EINECS 225-992-4;MFCD00007837;Methyl-5-chloroanthranilate;methyl 5-chloro-anthranilate;BIDD:GT0588;SCHEMBL267531;methyl 2 amino-5-chlorobenzoate;DTXSID90199992;5-Chloroanthanilic acid methyl ester;STK914000;AKOS000299138;5-chloro-anthranilic Acid Methyl Ester;CS-W008008;Methyl 2-amino-5-chlorobenzoate, 95%;NCGC00324248-01;AC-25994;SY007126;AM20060870;BB 0266924;FT-0600647;M1877;EN300-42979;8P-016;AB01319556-02;W-105855;Z54421842;F1943-0184

Chemical Property of Methyl 2-amino-5-chlorobenzoate

Chemical Property:

• Appearance/Colour: light yellow crystalline
• Vapor Pressure: 0.00168mmHg at 25°C
• Melting Point: 66-68 °C
• Refractive Index: 1.58
• Boiling Point: 293.9 °C at 760 mmHg
• PKA: 1.76±0.10(Predicted)
• Flash Point: 131.5 °C
• PSA: 52.32000
• Density: 1.311 g/cm³
• LogP: 2.29000
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• Solubility.: soluble in Methanol
• Water Solubility.: AUTOIGNITION
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 185.0243562
• Heavy Atom Count: 12
• Complexity: 174

Purity/Quality:

99% ^*data from raw suppliers

Methyl 2-Amino-5-chlorobenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC(=O)C1=C(C=CC(=C1)Cl)N
• Uses: Methyl 2-Amino-5-chlorobenzoate is a building block that has been used as a reactant for the preparation of bacterial RNA polymerase inhibitors.

Technology Process of Methyl 2-amino-5-chlorobenzoate

There total 20 articles about Methyl 2-amino-5-chlorobenzoate 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: 100.0%

methanol (67-56-1) + 5-chloroanthranilic acid (635-21-2) → 4-chlorobenzenesulfonyl chloride (5202-89-1)

Guidance literature:

With thionyl chloride; at 0 ℃; for 12h; Reflux;

Reference yield: 97.0%

5-Chloroisatoic anhydride (4743-17-3) + sodium methylate (124-41-4) → 4-chlorobenzenesulfonyl chloride (5202-89-1)

Guidance literature:

In methanol; for 3h; Reflux;

DOI:10.3390/molecules25040906

Reference yield: 96.0%

(CH3)2SO4 + 5-chloroanthranilic acid (635-21-2) → 4-chlorobenzenesulfonyl chloride (5202-89-1)

Guidance literature:

With potassium carbonate; In water; acetone;

upstream raw materials:

2-carbomethoxyaniline

methanol

5-chloroanthranilic acid

diazomethane

Downstream raw materials:

6-chloro-1,2,3,4-tetrahydroquinazoline-2,4-dione

methyl 2-amino-3-bromo-5-chlorobenzoate

6-chloroquinazolin-4-one

5-chloro-2-phenylazo-benzoic acid