1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-
TL;DR: 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- (CAS 32741-24-5) is a chemical compound with molecular formula C13H12O4 and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8-dihydroxy-2,6,7-trimethylnaphthalene-1,4-dione
Also Known As: 5,8-Dihydroxy-2,3,6-trimethylnaphthoquinone #, 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-, 2,3,6-trimethyl-5,8-dihydroxy-1,4-naphthoquinone, 5,8-DIHYDROXY-2,3,6-TRIMETHYLNAPHTHALENE-1,4-DIONE, 5,8-Dihydroxy-2,3,7-trimethyl-1,4-naphthalenedione
| Molecular Formula | C13H12O4 |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.07356 |
| Heavy Atoms | 17 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 32741-24-5 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(C(=C(C(=C2C1=O)O)C)C)O |
| InChIKey | ISQDKVIPTQHNSO-UHFFFAOYSA-N |
Product Overview
1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- (CAS 32741-24-5), with molecular formula C13H12O4 and molecular weight 232.07 g/mol. IUPAC: 5,8-dihydroxy-2,6,7-trimethylnaphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-
Property Insights of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-. Following Lipinski's Rule of Five, 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- has 2 hydrogen bond donor(s) and 4 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 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-?
The CAS number of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- is 32741-24-5.
What is the molecular formula of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-?
The molecular formula of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- is C13H12O4.
What is the molecular weight of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-?
The molecular weight of 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- is 232.07 g/mol.
Where can I buy 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-?
You can request a quote for 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedione, 5,8-dihydroxy-2,3,7-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.