Nicotine, sulfate (2:1)
TL;DR: Nicotine, sulfate (2:1) (CAS 65-30-5) is a chemical compound with molecular formula C20H30N4O4S and molecular weight 422.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(3-(1-methylpyrrolidin-2-yl)pyridine);sulfuric acid
Also Known As: Nicotine sulphate, Nikotinsulfat, Nicotine,sulfate, NICOTINE SULFATE, Black Leaf 40
| Molecular Formula | C20H30N4O4S |
|---|---|
| Molecular Weight | 422.20 g/mol |
| LogP | 3.04 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 422.1988 |
| Heavy Atoms | 29 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 65-30-5 |
|---|---|
| SMILES | CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.OS(=O)(=O)O |
| InChIKey | IECQULMJVNSKDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nicotine, sulfate (2:1) (CAS 65-30-5), with molecular formula C20H30N4O4S and molecular weight 422.20 g/mol. IUPAC: bis(3-(1-methylpyrrolidin-2-yl)pyridine);sulfuric acid.
Chemical Property Profile of Nicotine, sulfate (2:1)
Property Insights of Nicotine, sulfate (2:1)
The XLogP value of 3.04 indicates that Nicotine, sulfate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nicotine, sulfate (2:1). Following Lipinski's Rule of Five, Nicotine, sulfate (2:1) has 2 hydrogen bond donor(s) and 8 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 Nicotine, sulfate (2:1)?
The CAS number of Nicotine, sulfate (2:1) is 65-30-5.
What is the molecular formula of Nicotine, sulfate (2:1)?
The molecular formula of Nicotine, sulfate (2:1) is C20H30N4O4S.
What is the molecular weight of Nicotine, sulfate (2:1)?
The molecular weight of Nicotine, sulfate (2:1) is 422.20 g/mol.
Where can I buy Nicotine, sulfate (2:1)?
You can request a quote for Nicotine, sulfate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotine, sulfate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Nicotine, sulfate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.