Nicotinehydrochloride
TL;DR: Nicotinehydrochloride (CAS 69782-38-3) is a chemical compound with molecular formula C10H15ClN2 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-methylpyrrolidin-2-yl)pyridine;hydrochloride
Also Known As: Nicotinhydrochlorid, l-Nicotine hydrochloride, NICOTINEHYDROCHLORIDE, NICOTINE HYDROCHLORIDE, Nicotine, hydrochloride, (-)-
| Molecular Formula | C10H15ClN2 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 2.27 |
| Topological Polar Surface Area | 16.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.09238 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 69782-38-3 |
|---|---|
| SMILES | CN1CCCC1C2=CN=CC=C2.Cl |
| InChIKey | HDJBTCAJIMNXEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nicotinehydrochloride (CAS 69782-38-3), with molecular formula C10H15ClN2 and molecular weight 198.09 g/mol. IUPAC: 3-(1-methylpyrrolidin-2-yl)pyridine;hydrochloride.
Chemical Property Profile of Nicotinehydrochloride
Property Insights of Nicotinehydrochloride
The XLogP value of 2.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinehydrochloride. With a topological polar surface area (TPSA) of 16.1 Ų, Nicotinehydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinehydrochloride has 1 hydrogen bond donor(s) and 2 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 Nicotinehydrochloride?
The CAS number of Nicotinehydrochloride is 69782-38-3.
What is the molecular formula of Nicotinehydrochloride?
The molecular formula of Nicotinehydrochloride is C10H15ClN2.
What is the molecular weight of Nicotinehydrochloride?
The molecular weight of Nicotinehydrochloride is 198.09 g/mol.
Where can I buy Nicotinehydrochloride?
You can request a quote for Nicotinehydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinehydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Nicotinehydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.