![7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione structure](/static/products/1041/104199-02-2.webp)
7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione
TL;DR: 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione (CAS 104199-02-2) is a chemical compound with molecular formula C14H16O3 and molecular weight 232.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,13-dimethyl-2-oxatricyclo[7.3.1.05,13]trideca-6,10-diene-3,12-dione
Also Known As: 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione, Naphtho(1,8-bc)pyran-2,7-dione, 3,3a,6,6a,9a,9b-hexahydro-7,9b-dimethyl-, (3aalpha,6abeta,9aalpha,9balpha)-, 7,9b-Dimethyl-3,3a,6,6a,9a,9b-hexahydronaphtho[1,8-bc]pyran-2,9-dione
| Molecular Formula | C14H16O3 |
|---|---|
| Molecular Weight | 232.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.10994 |
| Heavy Atoms | 17 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 104199-02-2 |
|---|---|
| SMILES | CC1=CC(=O)C2C3(C1CC=CC3CC(=O)O2)C |
| InChIKey | CLAGZMXLPFFXKA-UHFFFAOYSA-N |
Product Overview
7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione (CAS 104199-02-2), with molecular formula C14H16O3 and molecular weight 232.11 g/mol. IUPAC: 10,13-dimethyl-2-oxatricyclo[7.3.1.05,13]trideca-6,10-diene-3,12-dione.
Chemical Property Profile of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione
Property Insights of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione has 0 hydrogen bond donor(s) and 3 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 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione?
The CAS number of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione is 104199-02-2.
What is the molecular formula of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione?
The molecular formula of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione is C14H16O3.
What is the molecular weight of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione?
The molecular weight of 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione is 232.11 g/mol.
Where can I buy 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione?
You can request a quote for 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione?
Yes, KEHONG BIO provides custom synthesis services for 7,9b-dimethyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.