5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione
TL;DR: 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione (CAS 28255-08-5) is a chemical compound with molecular formula C12H16O2 and molecular weight 192.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8a-dimethyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione
Also Known As: 7H>-naphthalenedione, 5,8a-dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione, 5,8a-dimethyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione, 019D710, 5,8a-Dimethyl-3,4,8,8a-tetrahydronaphthalene-1,6(2H,7H)-dione
| Molecular Formula | C12H16O2 |
|---|---|
| Molecular Weight | 192.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.11504 |
| Heavy Atoms | 14 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 28255-08-5 |
|---|---|
| SMILES | CC1=C2CCCC(=O)C2(CCC1=O)C |
| InChIKey | YMSJMUXZPBXLSI-UHFFFAOYSA-N |
Product Overview
5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione (CAS 28255-08-5), with molecular formula C12H16O2 and molecular weight 192.12 g/mol. IUPAC: 5,8a-dimethyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione.
Chemical Property Profile of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione
Property Insights of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione. With a topological polar surface area (TPSA) of 34.1 Ų, 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione 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 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione?
The CAS number of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione is 28255-08-5.
What is the molecular formula of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione?
The molecular formula of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione is C12H16O2.
What is the molecular weight of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione?
The molecular weight of 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione is 192.12 g/mol.
Where can I buy 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione?
You can request a quote for 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione?
Yes, KEHONG BIO provides custom synthesis services for 5,8a-Dimethyl-3,4,8,8a-tetrahydro-1,6-(2h,7h)-naphthalenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.