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Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione
TL;DR: Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione (CAS 104487-92-5) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetracyclo[7.2.1.04,11.06,10]dodecane-5,12-dione
Also Known As: DECAHYDRODICYCLOPENTA[CD,GH]PENTALENE-3,6-DIONE, tetracyclo(7.2.1.04,11.06,10)dodecane-5,12-dione, Dicyclopenta(cd,gh)pentalene-3,6-dione, 2a,3a,5a,6a,6b,6c-hexahydro-, tetracyclo[7.2.1.04.11.06.10]dodeca-2,7-diene-5,12-dione, (2aR,3aS,5aR,6aS,6bS,6cS)-2a,3a,5a,6a,6b,6c-Hexahydro-dicyclopenta[cd,gh]pentalene-3,6-dione
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 104487-92-5 |
|---|---|
| SMILES | C1CC2C3C1C(=O)C4C3C(C2=O)CC4 |
| InChIKey | LOBDTEAMNCFGCJ-UHFFFAOYSA-N |
Product Overview
Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione (CAS 104487-92-5), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: tetracyclo[7.2.1.04,11.06,10]dodecane-5,12-dione.
Chemical Property Profile of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione
Property Insights of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione. With a topological polar surface area (TPSA) of 34.1 Ų, Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decahydrodicyclopenta[CD,GH]pentalene-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 Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione?
The CAS number of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione is 104487-92-5.
What is the molecular formula of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione?
The molecular formula of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione is C12H14O2.
What is the molecular weight of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione?
The molecular weight of Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione is 190.10 g/mol.
Where can I buy Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione?
You can request a quote for Decahydrodicyclopenta[CD,GH]pentalene-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 Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione?
Yes, KEHONG BIO provides custom synthesis services for Decahydrodicyclopenta[CD,GH]pentalene-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.