Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)
TL;DR: Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) (CAS 30234-90-3) is a chemical compound with molecular formula C12H10O and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one
Also Known As: 1H-4,9-methano[11]annulen-1-one, 4,9-methano[11]annulenone, bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one, 4,9-Methanocycloundeca-2,4,6,8,10-pentene-1-one, Bicyclo[5.4.1]dodeca-2,5,7,9,11-pentaen-4-one
| Molecular Formula | C12H10O |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | 2.4942 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.07317 |
| Heavy Atoms | 13 |
| Complexity | 341.92865 |
Chemical Identifiers
| CAS Number | 30234-90-3 |
|---|---|
| SMILES | C1C2=CC=CC=C1C=CC(=O)C=C2 |
Product Overview
Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) (CAS 30234-90-3), with molecular formula C12H10O and molecular weight 170.07 g/mol. IUPAC: bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one.
Chemical Property Profile of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)
Property Insights of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)
The XLogP value of 2.4942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en). With a topological polar surface area (TPSA) of 17.07 Ų, Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) 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[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)?
The CAS number of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) is 30234-90-3.
What is the molecular formula of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)?
The molecular formula of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) is C12H10O.
What is the molecular weight of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)?
The molecular weight of Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) is 170.07 g/mol.
Where can I buy Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)?
You can request a quote for Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en)?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[5.4.1]dodeca-1(11),2,5,7,9-pentaen-4-one (en) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.