![Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate structure](/static/products/1257/125736-37-0.webp)
Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate
TL;DR: Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate (CAS 125736-37-0) is a chemical compound with molecular formula C15H24BrNO4 and molecular weight 361.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-O-tert-butyl 2-O-methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate
Also Known As: Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate, 9-Azabicyclo(4.2.1)nonane-2,9-dicarboxylic acid, 2-bromo-, 9-(1,1-dimethylethyl) 2-methyl ester, endo-, 9-tert-butyl 2-methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate, 5-O-tert-butyl 9-O-methyl 5-bromo-9-azabicyclo[4.2.1]nonane-5,9-dicarboxylate, 9-O-tert-butyl 5-O-methyl 5-bromo-9-azabicyclo[4.2.1]nonane-5,9-dicarboxylate
| Molecular Formula | C15H24BrNO4 |
|---|---|
| Molecular Weight | 361.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.08887 |
| Heavy Atoms | 21 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 125736-37-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C2CCCC(C1CC2)(C(=O)OC)Br |
| InChIKey | LELPQEPATWWEOQ-UHFFFAOYSA-N |
Product Overview
Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate (CAS 125736-37-0), with molecular formula C15H24BrNO4 and molecular weight 361.09 g/mol. IUPAC: 9-O-tert-butyl 2-O-methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate.
Chemical Property Profile of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate
Property Insights of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate
The XLogP value of 3.1 indicates that Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate?
The CAS number of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate is 125736-37-0.
What is the molecular formula of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate?
The molecular formula of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate is C15H24BrNO4.
What is the molecular weight of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate?
The molecular weight of Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate is 361.09 g/mol.
Where can I buy Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate?
You can request a quote for Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl Methyl 2-bromo-9-azabicyclo[4.2.1]nonane-2,9-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.