5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione
TL;DR: 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione (CAS 54889-74-6) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-8,8-dimethyl-6,7-dihydro-5H-anthracene-1,4-dione
Also Known As: 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione, 1,4-Anthracenedione, 5,6,7,8-tetrahydro-2-methoxy-5,5-dimethyl-, 3-methoxy-8,8-dimethyl-6,7-dihydro-5H-anthracene-1,4-dione, 2-methoxy-5,5-dimethyl-1,4,5,6,7,8-hexahydroanthracene-1,4-dione, 2-Methoxy-5,5-dimethyl-5,6,7,8-tetrahydro-1,4-anthracenedione
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 54889-74-6 |
|---|---|
| SMILES | CC1(CCCC2=CC3=C(C=C21)C(=O)C=C(C3=O)OC)C |
| InChIKey | QZAHTDMEYDBFTQ-UHFFFAOYSA-N |
Product Overview
5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione (CAS 54889-74-6), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: 3-methoxy-8,8-dimethyl-6,7-dihydro-5H-anthracene-1,4-dione.
Chemical Property Profile of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione
Property Insights of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione
The XLogP value of 3.9 indicates that 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-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 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione?
The CAS number of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione is 54889-74-6.
What is the molecular formula of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione?
The molecular formula of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione is C17H18O3.
What is the molecular weight of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione?
The molecular weight of 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione is 270.13 g/mol.
Where can I buy 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione?
You can request a quote for 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8-Tetrahydro-2-methoxy-5,5-dimethylanthracene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.