3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide
TL;DR: 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide (CAS 102585-68-2) is a chemical compound with molecular formula C16H25IN2 and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonane iodide
Also Known As: 3-Benzyl-9,9-dimethyl-3-aza-9-azoniabicyclo(3.3.1)nonane iodide, 3-AZA-9-AZONIABICYCLO(3.3.1)NONANE, 3-BENZYL-9,9-DIMETHYL-, IODIDE, 3-Benzyl-9,9-dimethyl-3,9-diazabicyclo[3.3.1]nonan-9-ium iodide, 3-benzyl-9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonane iodide, RefChem:276715
| Molecular Formula | C16H25IN2 |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.10626 |
| Heavy Atoms | 19 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 102585-68-2 |
|---|---|
| SMILES | C[N+]1(C2CCCC1CN(C2)CC3=CC=CC=C3)C.[I-] |
| InChIKey | QGHGSRCFDKPLRB-UHFFFAOYSA-M |
Product Overview
3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide (CAS 102585-68-2), with molecular formula C16H25IN2 and molecular weight 372.11 g/mol. IUPAC: 3-benzyl-9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonane iodide.
Chemical Property Profile of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide
Property Insights of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide
The XLogP value of -0.5 indicates that 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.2 Ų, 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide has 0 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 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide?
The CAS number of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide is 102585-68-2.
What is the molecular formula of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide?
The molecular formula of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide is C16H25IN2.
What is the molecular weight of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide?
The molecular weight of 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide is 372.11 g/mol.
Where can I buy 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide?
You can request a quote for 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3-benzyl-9,9-dimethyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.