2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)
TL;DR: 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) (CAS 87330-70-9) is a chemical compound with molecular formula C8H12Cl2N2O2 and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethyl pyridine-3-carboxylate;dihydrochloride
Also Known As: starbld0009795, 2-aminoethyl nicotinate dihydrochloride, Nicotinic Acid 2-Aminoethyl Ester Dihydrochloride, 2-Aminoethyl 3-pyridinecarboxylate dihydrochloride, Nicorandil EP Impurity C Di HCl
| Molecular Formula | C8H12Cl2N2O2 |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 1.0407 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.02759 |
| Heavy Atoms | 14 |
| Complexity | 256.778 |
Chemical Identifiers
| CAS Number | 87330-70-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)OCCN.Cl.Cl |
Product Overview
2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) (CAS 87330-70-9), with molecular formula C8H12Cl2N2O2 and molecular weight 238.03 g/mol. IUPAC: 2-aminoethyl pyridine-3-carboxylate;dihydrochloride.
Chemical Property Profile of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)
Property Insights of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)
The XLogP value of 1.0407 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2). The TPSA of 65.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2). Following Lipinski's Rule of Five, 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)?
The CAS number of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) is 87330-70-9.
What is the molecular formula of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)?
The molecular formula of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) is C8H12Cl2N2O2.
What is the molecular weight of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)?
The molecular weight of 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) is 238.03 g/mol.
Where can I buy 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)?
You can request a quote for 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2)?
Yes, KEHONG BIO provides custom synthesis services for 2-Aminoethyl pyridine-3-carboxylate--hydrogen chloride (1/2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.