![4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione structure](/static/products/7005/70050-88-3.webp)
4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione
TL;DR: 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione (CAS 70050-88-3) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyltricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione
Also Known As: 4-Methyltricyclo[6.2.1.0,2,7]undeca-4,9-diene-3,6-dione, 4-methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione, 4-methyltricyclo[6.2.1.0?,?]undeca-4,9-diene-3,6-dione, 4-methyltricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione, Tricyclo[6.2.1.0(2,7)]undeca-4,9-diene, 4-methyl-3,6-dioxo-
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.08372 |
| Heavy Atoms | 14 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 70050-88-3 |
|---|---|
| SMILES | CC1=CC(=O)C2C3CC(C2C1=O)C=C3 |
| InChIKey | VVJNELUVYOGFDK-UHFFFAOYSA-N |
Product Overview
4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione (CAS 70050-88-3), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: 4-methyltricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione.
Chemical Property Profile of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione
Property Insights of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione. With a topological polar surface area (TPSA) of 34.1 Ų, 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione has 0 hydrogen bond donor(s) and 2 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 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione?
The CAS number of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione is 70050-88-3.
What is the molecular formula of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione?
The molecular formula of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione is C12H12O2.
What is the molecular weight of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione?
The molecular weight of 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione is 188.08 g/mol.
Where can I buy 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione?
You can request a quote for 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyltricyclo[6.2.1.0^{2,7}]undeca-4,9-diene-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.