![[3.3.3]Propellane-2-one, 8,9-bis(methylene)- structure](/static/products/5843/58435-05-5.webp)
[3.3.3]Propellane-2-one, 8,9-bis(methylene)-
TL;DR: [3.3.3]Propellane-2-one, 8,9-bis(methylene)- (CAS 58435-05-5) is a chemical compound with molecular formula C13H16O and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9-dimethylidenetricyclo[3.3.3.01,5]undecan-2-one
Also Known As: [3.3.3]Propellane-2-one, 8,9-bis(methylene)-|(3.3.3)-Propellane-2-one, 8,9-bis(methylene)-|6,7-dimethylidenetetrahydro-1H,4H-3a,6a-propanopentalen-1-one
| Molecular Formula | C13H16O |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.12012 |
| Heavy Atoms | 14 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 58435-05-5 |
|---|---|
| SMILES | C=C1CCC23C1(C(=C)CC2)C(=O)CC3 |
| InChIKey | FRBFVMMKTNLPDM-UHFFFAOYSA-N |
Product Overview
[3.3.3]Propellane-2-one, 8,9-bis(methylene)- (CAS 58435-05-5), with molecular formula C13H16O and molecular weight 188.12 g/mol. IUPAC: 8,9-dimethylidenetricyclo[3.3.3.01,5]undecan-2-one.
Chemical Property Profile of [3.3.3]Propellane-2-one, 8,9-bis(methylene)-
Property Insights of [3.3.3]Propellane-2-one, 8,9-bis(methylene)-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3.3.3]Propellane-2-one, 8,9-bis(methylene)-. With a topological polar surface area (TPSA) of 17.1 Ų, [3.3.3]Propellane-2-one, 8,9-bis(methylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3.3.3]Propellane-2-one, 8,9-bis(methylene)- 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 [3.3.3]Propellane-2-one, 8,9-bis(methylene)-?
The CAS number of [3.3.3]Propellane-2-one, 8,9-bis(methylene)- is 58435-05-5.
What is the molecular formula of [3.3.3]Propellane-2-one, 8,9-bis(methylene)-?
The molecular formula of [3.3.3]Propellane-2-one, 8,9-bis(methylene)- is C13H16O.
What is the molecular weight of [3.3.3]Propellane-2-one, 8,9-bis(methylene)-?
The molecular weight of [3.3.3]Propellane-2-one, 8,9-bis(methylene)- is 188.12 g/mol.
Where can I buy [3.3.3]Propellane-2-one, 8,9-bis(methylene)-?
You can request a quote for [3.3.3]Propellane-2-one, 8,9-bis(methylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3.3.3]Propellane-2-one, 8,9-bis(methylene)-?
Yes, KEHONG BIO provides custom synthesis services for [3.3.3]Propellane-2-one, 8,9-bis(methylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.