![[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate structure](/static/products/5196/5196-56-5.webp)
[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
TL;DR: [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate (CAS 5196-56-5) is a chemical compound with molecular formula C30H33NO3 and molecular weight 455.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
Also Known As: [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate|9-[(4-Methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl hydroxydi(phenyl)acetate
| Molecular Formula | C30H33NO3 |
|---|---|
| Molecular Weight | 455.25 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.24603 |
| Heavy Atoms | 34 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 5196-56-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3CCCC2CC(C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O |
| InChIKey | QVTUVHUBWWSREU-UHFFFAOYSA-N |
Product Overview
[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate (CAS 5196-56-5), with molecular formula C30H33NO3 and molecular weight 455.25 g/mol. IUPAC: [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
Property Insights of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
The XLogP value of 6.1 indicates that [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate?
The CAS number of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate is 5196-56-5.
What is the molecular formula of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate?
The molecular formula of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate is C30H33NO3.
What is the molecular weight of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate?
The molecular weight of [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate is 455.25 g/mol.
Where can I buy [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate?
You can request a quote for [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for [9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.