Vermelone
TL;DR: Vermelone (CAS 59069-54-4) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-dihydroxy-3,4-dihydro-2H-naphthalen-1-one
Also Known As: Vermelone, 4,8-Dihydroxy-1-tetralon, 3,8-Dihydroxytetralin-1-one, 3,4-Dihydro-3,8-dihydroxy-1(2H)-naphthalenone, 3,8-dihydroxy-3,4-dihydro-2H-naphthalen-1-one
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 59069-54-4 |
|---|---|
| SMILES | C1C(CC(=O)C2=C1C=CC=C2O)O |
| InChIKey | AQTKGZASUQVMEJ-UHFFFAOYSA-N |
Product Overview
Vermelone (CAS 59069-54-4), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: 3,8-dihydroxy-3,4-dihydro-2H-naphthalen-1-one.
Chemical Property Profile of Vermelone
Property Insights of Vermelone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vermelone. With a topological polar surface area (TPSA) of 57.5 Ų, Vermelone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vermelone has 2 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 Vermelone?
The CAS number of Vermelone is 59069-54-4.
What is the molecular formula of Vermelone?
The molecular formula of Vermelone is C10H10O3.
What is the molecular weight of Vermelone?
The molecular weight of Vermelone is 178.06 g/mol.
Where can I buy Vermelone?
You can request a quote for Vermelone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vermelone?
Yes, KEHONG BIO provides custom synthesis services for Vermelone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.