Phthiocol
TL;DR: Phthiocol (CAS 483-55-6) is a chemical compound with molecular formula C11H8O3 and molecular weight 188.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-methylnaphthalene-1,2-dione
Also Known As: Phthiocol, Phthiokol, 2-Hydroxy-3-methyl-1,4-naphthoquinone, Phthiacol, Not named
| Molecular Formula | C11H8O3 |
|---|---|
| Molecular Weight | 188.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.04735 |
| Heavy Atoms | 14 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 483-55-6 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2C(=O)C1=O)O |
| InChIKey | BGVCGTNXEKDVCB-UHFFFAOYSA-N |
Product Overview
Phthiocol (CAS 483-55-6), with molecular formula C11H8O3 and molecular weight 188.05 g/mol. IUPAC: 4-hydroxy-3-methylnaphthalene-1,2-dione.
Chemical Property Profile of Phthiocol
Property Insights of Phthiocol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phthiocol. With a topological polar surface area (TPSA) of 54.4 Ų, Phthiocol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phthiocol has 1 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 Phthiocol?
The CAS number of Phthiocol is 483-55-6.
What is the molecular formula of Phthiocol?
The molecular formula of Phthiocol is C11H8O3.
What is the molecular weight of Phthiocol?
The molecular weight of Phthiocol is 188.05 g/mol.
Where can I buy Phthiocol?
You can request a quote for Phthiocol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthiocol?
Yes, KEHONG BIO provides custom synthesis services for Phthiocol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.