1,4,5-萘三酚
TL;DR: 1,4,5-萘三酚 (CAS 481-40-3) is a chemical compound with molecular formula C10H8O3 and molecular weight 176.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5-萘三酚
naphthalene-1,4,5-triol
Also Known As: Naphthalene-1,4,5-triol, 1,4,5-Naphthalenetriol, 1,4,5-Trihydroxynaphthalene, a-Hydrojuglone, alpha-Hydrojuglone
| Molecular Formula | C10H8O3 |
|---|---|
| Molecular Weight | 176.05 g/mol |
| LogP | 1.9566 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.04735 |
| Heavy Atoms | 13 |
| Complexity | 454.67166 |
Chemical Identifiers
| CAS Number | 481-40-3 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2C(=C1)O)O)O |
Product Overview
1,4,5-萘三酚 (CAS 481-40-3), with molecular formula C10H8O3 and molecular weight 176.05 g/mol. IUPAC: naphthalene-1,4,5-triol.
Chemical Property Profile of 1,4,5-萘三酚
Property Insights of 1,4,5-萘三酚
The XLogP value of 1.9566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,5-萘三酚. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,5-萘三酚. Following Lipinski's Rule of Five, 1,4,5-萘三酚 has 3 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 1,4,5-萘三酚?
The CAS number of 1,4,5-萘三酚 is 481-40-3.
What is the molecular formula of 1,4,5-萘三酚?
The molecular formula of 1,4,5-萘三酚 is C10H8O3.
What is the molecular weight of 1,4,5-萘三酚?
The molecular weight of 1,4,5-萘三酚 is 176.05 g/mol.
Where can I buy 1,4,5-萘三酚?
You can request a quote for 1,4,5-萘三酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,5-萘三酚?
Yes, KEHONG BIO provides custom synthesis services for 1,4,5-萘三酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.