2-Aminoethyl 3-pyridinecarboxylate dihydrochloride

Base Information

• Chemical Name: 2-Aminoethyl 3-pyridinecarboxylate dihydrochloride
• CAS No.: 87330-70-9
• Molecular Formula: C₈H₁₀N₂O₂*2ClH
• Molecular Weight: 239.101
• DSSTox Substance ID: DTXSID401007493
• Mol file: 87330-70-9.mol

Synonyms:87330-70-9;2-aminoethyl nicotinate dihydrochloride;2-Aminoethyl 3-pyridinecarboxylate dihydrochloride;Nicotinic Acid 2-Aminoethyl Ester Dihydrochloride;2-aminoethyl pyridine-3-carboxylate;dihydrochloride;3-Pyridinecarboxylic acid, 2-aminoethyl ester, dihydrochloride;C8H10N2O2.2ClH;C8-H10-N2-O2.2Cl-H;starbld0009795;SCHEMBL8728483;VPJHTGIKTFWBEW-UHFFFAOYSA-N;DTXSID401007493;BCP34344;2aminoethyl nicotinate dihydrochloride;LS-130716;2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2);3-Pyridinecarboxylic Acid 2-Aminoethyl Ester Dihydrochloride

Chemical Property of 2-Aminoethyl 3-pyridinecarboxylate dihydrochloride

Chemical Property:

• Vapor Pressure: 0.00302mmHg at 25°C
• Boiling Point: 284.2°Cat760mmHg
• Flash Point: 125.7°C
• PSA: 65.21000
• Density: g/cm³
• LogP: 2.50140
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 238.0275830
• Heavy Atom Count: 14
• Complexity: 150

Purity/Quality:

Nicotinic acid 2-aminoethyl ester dihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CN=C1)C(=O)OCCN.Cl.Cl
• Uses: 3-Pyridinecarboxylic Acid 2-AMinoethyl Ester Dihydrochloride is an ester derivative of Nicotinic Acid with potential anticholesteremic activity. It is used in the preparation of hypolipidemic agents. Nicotinic Acid 2-Aminoethyl Ester is an ester derivative of Nicotinic Acid with potential anticholesteremic activity. It is used in the preparation of hypolipidemic agents.

Technology Process of 2-Aminoethyl 3-pyridinecarboxylate dihydrochloride

There total 5 articles about 2-Aminoethyl 3-pyridinecarboxylate dihydrochloride 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: 76.0%

pyridine-3-carbonyl chloride hydrochloride (20260-53-1) + ethanolamine (141-43-5) → nicotinoyloxyethylamine hydrochloride (72676-16-5,87330-70-9)

Guidance literature:

With hydrogenchloride; In 1,2-dichloro-ethane;

DOI:10.1248/cpb.31.4116

Reference yield:

N-(2-hydroxyethyl)nicotinamide (6265-73-2) → nicotinoyloxyethylamine hydrochloride (72676-16-5,87330-70-9)

Guidance literature:

With hydrogenchloride; ethanol;

DOI:10.1021/ja01194a003

Reference yield:

methyl 3-pyridinecarboxylate (93-60-7) → nicotinoyloxyethylamine hydrochloride (72676-16-5,87330-70-9)

Guidance literature:

Multi-step reaction with 2 steps

2: HCl; ethanol

With hydrogenchloride; ethanol;

DOI:10.1021/ja01194a003

upstream raw materials:

2-(pyridin-3-yl)-4,5-dihydrooxazole

N-(2-hydroxyethyl)nicotinamide

pyridine-3-carbonyl chloride hydrochloride

ethanolamine