9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-
TL;DR: 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- (CAS 64776-36-9) is a chemical compound with molecular formula C12H23N and molecular weight 181.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-tert-butyl-9-azabicyclo[3.3.1]nonane
Also Known As: 9-tert-butyl-9-azabicyclo[3.3.1]nonane, 9-tert-butyl-9-azabicyclo(3.3.1)nonane, 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-, 9-t-butyl-9-azabicyclo[3.3.1]nonane, 9-Azabicyclo[3.3.1]nonane,9-(1,1-dimethylethyl)-
| Molecular Formula | C12H23N |
|---|---|
| Molecular Weight | 181.18 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.18304 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 64776-36-9 |
|---|---|
| SMILES | CC(C)(C)N1C2CCCC1CCC2 |
| InChIKey | AGBMODCOFGRWIE-UHFFFAOYSA-N |
Product Overview
9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- (CAS 64776-36-9), with molecular formula C12H23N and molecular weight 181.18 g/mol. IUPAC: 9-tert-butyl-9-azabicyclo[3.3.1]nonane.
Chemical Property Profile of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-
Property Insights of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-
The XLogP value of 3.1 indicates that 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- 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 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-?
The CAS number of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- is 64776-36-9.
What is the molecular formula of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-?
The molecular formula of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- is C12H23N.
What is the molecular weight of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-?
The molecular weight of 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- is 181.18 g/mol.
Where can I buy 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-?
You can request a quote for 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9-Azabicyclo(3.3.1)nonane, 9-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.