Einecs 261-294-6
TL;DR: Einecs 261-294-6 (CAS 58501-32-9) is a chemical compound with molecular formula C15H19ClN- and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S,13R)-N,N-dimethyltricyclo[7.3.1.02,7]trideca-2,4,6,10-tetraen-13-amine chloride
Also Known As: Silicon tin oxide, EINECS 261-294-6, (5alpha,9alpha,11R*)-Dimethyl(5,6,9,10-tetrahydro-5,9-methanobenzocycloocten-11-yl)ammonium chloride, (5alpha,9alpha,11R*)-dimethyl[5,6,9,10-tetrahydro-5,9-methanobenzocycloocten-11-yl]ammonium chloride
| Molecular Formula | C15H19ClN- |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | -0.1634 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.1206 |
| Heavy Atoms | 17 |
| Complexity | 424.68494 |
Chemical Identifiers
| CAS Number | 58501-32-9 |
|---|---|
| SMILES | CN(C)[C@H]1[C@@H]2CC=C[C@@H]1CC3=CC=CC=C23.[Cl-] |
Product Overview
Einecs 261-294-6 (CAS 58501-32-9), with molecular formula C15H19ClN- and molecular weight 248.12 g/mol. IUPAC: (1R,9S,13R)-N,N-dimethyltricyclo[7.3.1.02,7]trideca-2,4,6,10-tetraen-13-amine chloride.
Chemical Property Profile of Einecs 261-294-6
Property Insights of Einecs 261-294-6
The XLogP value of -0.1634 indicates that Einecs 261-294-6 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.24 Ų, Einecs 261-294-6 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 261-294-6 has 0 hydrogen bond donor(s) and 1 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 Einecs 261-294-6?
The CAS number of Einecs 261-294-6 is 58501-32-9.
What is the molecular formula of Einecs 261-294-6?
The molecular formula of Einecs 261-294-6 is C15H19ClN-.
What is the molecular weight of Einecs 261-294-6?
The molecular weight of Einecs 261-294-6 is 248.12 g/mol.
Where can I buy Einecs 261-294-6?
You can request a quote for Einecs 261-294-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 261-294-6?
Yes, KEHONG BIO provides custom synthesis services for Einecs 261-294-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.