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Bicyclo[4.2.1]non-7-en-9-one
TL;DR: Bicyclo[4.2.1]non-7-en-9-one (CAS 42948-91-4) is a chemical compound with molecular formula C9H12O and molecular weight 136.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[4.2.1]non-7-en-9-one
Also Known As: Bicyclo[4.2.1]non-7-en-9-one, Bicyclo(4.2.1)non-7-en-9-one, Propanediamide,2-ethyl-N,N,N',N'-tetramethyl-2-phenyl
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 42948-91-4 |
|---|---|
| SMILES | C1CCC2C=CC(C1)C2=O |
| InChIKey | ZHYGEBKAXXIIPD-UHFFFAOYSA-N |
Product Overview
Bicyclo[4.2.1]non-7-en-9-one (CAS 42948-91-4), with molecular formula C9H12O and molecular weight 136.09 g/mol. IUPAC: bicyclo[4.2.1]non-7-en-9-one.
Chemical Property Profile of Bicyclo[4.2.1]non-7-en-9-one
Property Insights of Bicyclo[4.2.1]non-7-en-9-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[4.2.1]non-7-en-9-one. With a topological polar surface area (TPSA) of 17.1 Ų, Bicyclo[4.2.1]non-7-en-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[4.2.1]non-7-en-9-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[4.2.1]non-7-en-9-one?
The CAS number of Bicyclo[4.2.1]non-7-en-9-one is 42948-91-4.
What is the molecular formula of Bicyclo[4.2.1]non-7-en-9-one?
The molecular formula of Bicyclo[4.2.1]non-7-en-9-one is C9H12O.
What is the molecular weight of Bicyclo[4.2.1]non-7-en-9-one?
The molecular weight of Bicyclo[4.2.1]non-7-en-9-one is 136.09 g/mol.
Where can I buy Bicyclo[4.2.1]non-7-en-9-one?
You can request a quote for Bicyclo[4.2.1]non-7-en-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[4.2.1]non-7-en-9-one?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[4.2.1]non-7-en-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.