4-Hydroxy-3-propylnaphthalene-1,2-dione
TL;DR: 4-Hydroxy-3-propylnaphthalene-1,2-dione (CAS 29366-45-8) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-propylnaphthalene-1,2-dione
Also Known As: 4-hydroxy-3-propylnaphthalene-1,2-dione, 2-Hydroxy-3-propylnaphthoquinone #, 1,4-Naphthoquinone, 2-hydroxy-3-propyl-, 1,4-Naphthalenedione, 2-hydroxy-3-propyl-, 3-Hydroxy-2-propyl-1,4-naphthoquinone
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 29366-45-8 |
|---|---|
| SMILES | CCCC1=C(C2=CC=CC=C2C(=O)C1=O)O |
| InChIKey | OEBPBHCPSQPAOS-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-3-propylnaphthalene-1,2-dione (CAS 29366-45-8), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 4-hydroxy-3-propylnaphthalene-1,2-dione.
Chemical Property Profile of 4-Hydroxy-3-propylnaphthalene-1,2-dione
Property Insights of 4-Hydroxy-3-propylnaphthalene-1,2-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3-propylnaphthalene-1,2-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 4-Hydroxy-3-propylnaphthalene-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-3-propylnaphthalene-1,2-dione 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 4-Hydroxy-3-propylnaphthalene-1,2-dione?
The CAS number of 4-Hydroxy-3-propylnaphthalene-1,2-dione is 29366-45-8.
What is the molecular formula of 4-Hydroxy-3-propylnaphthalene-1,2-dione?
The molecular formula of 4-Hydroxy-3-propylnaphthalene-1,2-dione is C13H12O3.
What is the molecular weight of 4-Hydroxy-3-propylnaphthalene-1,2-dione?
The molecular weight of 4-Hydroxy-3-propylnaphthalene-1,2-dione is 216.08 g/mol.
Where can I buy 4-Hydroxy-3-propylnaphthalene-1,2-dione?
You can request a quote for 4-Hydroxy-3-propylnaphthalene-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3-propylnaphthalene-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3-propylnaphthalene-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.