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Bicyclo[3.2.1]octan-2-one
TL;DR: Bicyclo[3.2.1]octan-2-one (CAS 5019-82-9) is a chemical compound with molecular formula C8H12O and molecular weight 124.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[3.2.1]octan-2-one
Also Known As: Bicyclo[3.2.1]octan-2-one, Bicyclo(3.2.1)octan-2-one, bicyclo[3.2.1]octan-4-one, Bicyclo[3,2,1]octan-2-one, Bicyclo[3.2.1]octanone
| Molecular Formula | C8H12O |
|---|---|
| Molecular Weight | 124.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.08881 |
| Heavy Atoms | 9 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 5019-82-9 |
|---|---|
| SMILES | C1CC2CC1CCC2=O |
| InChIKey | SXFPXZSENHPCSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[3.2.1]octan-2-one (CAS 5019-82-9), with molecular formula C8H12O and molecular weight 124.09 g/mol. IUPAC: bicyclo[3.2.1]octan-2-one.
Chemical Property Profile of Bicyclo[3.2.1]octan-2-one
Property Insights of Bicyclo[3.2.1]octan-2-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[3.2.1]octan-2-one. With a topological polar surface area (TPSA) of 17.1 Ų, Bicyclo[3.2.1]octan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.2.1]octan-2-one 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 Bicyclo[3.2.1]octan-2-one?
The CAS number of Bicyclo[3.2.1]octan-2-one is 5019-82-9.
What is the molecular formula of Bicyclo[3.2.1]octan-2-one?
The molecular formula of Bicyclo[3.2.1]octan-2-one is C8H12O.
What is the molecular weight of Bicyclo[3.2.1]octan-2-one?
The molecular weight of Bicyclo[3.2.1]octan-2-one is 124.09 g/mol.
Where can I buy Bicyclo[3.2.1]octan-2-one?
You can request a quote for Bicyclo[3.2.1]octan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[3.2.1]octan-2-one?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[3.2.1]octan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.