Ethyl 2-aminoisonicotinate

Base Information

• Chemical Name: Ethyl 2-aminoisonicotinate
• CAS No.: 13362-30-6
• Molecular Formula: C8H10N2O2
• Molecular Weight: 166.18
• Hs Code.: 29333990
• European Community (EC) Number: 689-078-0
• DSSTox Substance ID: DTXSID20426743
• Wikidata: Q72472426
• Mol file: 13362-30-6.mol

Synonyms:13362-30-6;Ethyl 2-aminoisonicotinate;2-Amino-isonicotinic acid ethyl ester;Ethyl 2-aminopyridine-4-carboxylate;2-Aminoisonicotinic acid ethyl ester;Ethyl 2-amino-4-pyridinecarboxylate;MFCD03791260;4-PYRIDINECARBOXYLIC ACID, 2-AMINO-, ETHYL ESTER;2-amino-4-ethoxycarbonylpyridine;2-Amino-4-pyridinecarboxylic acid ethyl ester;SCHEMBL256755;ETHYL2-AMINOISONICOTINATE;DTXSID20426743;XVBZFXZNJAFCHL-UHFFFAOYSA-N;CS-D1173;TD1284;AKOS006345961;AB16201;ME-0233;AC-23476;SY013136;AM20050774;E0944;FT-0649878;2-amino-pyridine-4-carboxylic acid ethyl ester;EN300-870204;2-Amino-isonicotinic acid ethyl ester, AldrichCPR;A806650;W-204301;W-205426;2-AMINOPYRIDINE-4-CARBOXYLIC ACID ETHYL ESTER;2-amino-3-ethyl-pyridine-4-carboxylate

Chemical Property of Ethyl 2-aminoisonicotinate

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Melting Point: 123.5-123.6°C
• Refractive Index: 1.559
• Boiling Point: 307.223 °C at 760 mmHg
• PKA: 4.97±0.11(Predicted)
• Flash Point: 139.604 °C
• PSA: 65.21000
• Density: 1.193 g/cm³
• LogP: 1.42170
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Water Solubility.: Slightly soluble in water.
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 166.074227566
• Heavy Atom Count: 12
• Complexity: 161

Purity/Quality:

97% ^*data from raw suppliers

Ethyl 2-Aminoisonicotinate ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC(=NC=C1)N
• Uses: Ethyl 2-aminopyridine-4-carboxylate is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields.

Technology Process of Ethyl 2-aminoisonicotinate

There total 11 articles about Ethyl 2-aminoisonicotinate 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: 95.1%

ethanol (64-17-5) + 2-aminoisonicotinic acid (13362-28-2) → 2-amino-4-ethoxycarbonyl-pyridine (13362-30-6)

Guidance literature:

With oxygen; In water; at 20 - 80 ℃; for 2h; pH=9; Temperature; pH-value; Reflux;

Reference yield: 79.0%

ethanol (64-17-5) + 2-(acetylamino)isonicotinic acid (54221-95-3) → 2-amino-4-ethoxycarbonyl-pyridine (13362-30-6)

Guidance literature:

With boron trifluoride diethyl etherate; Heating;

DOI:10.1016/j.bmc.2003.12.039

Reference yield:

C26H23N2O2P → 2-amino-4-ethoxycarbonyl-pyridine (13362-30-6)

Guidance literature:

With hydrogenchloride; In dimethyl sulfoxide; at 120 ℃; for 2h;

DOI:10.1016/j.tetlet.2012.11.027

upstream raw materials:

2-(acetylamino)isonicotinic acid

ethanol

2-Amino-4-methylpyridine

2-acetylamino-4-methylpyridine

Downstream raw materials:

[3-(2-aminopyrimidin-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol

[2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol

4-[7-[(dimethylamino)methyl]-2-(4-fluorphenyl)imidazo[1,2-α]pyridine-3-yl]pyrimidin-2-amine

methanesulfonic acid 3-(2-amino-pyrimidin-4-yl)-2-(4-fluoro-phenyl)-imidazo[1,2-a]pyridin-7-ylmethyl ester