2-Acetyl-3-phenylnaphthalene-1,4-dione
TL;DR: 2-Acetyl-3-phenylnaphthalene-1,4-dione (CAS 5329-73-7) is a chemical compound with molecular formula C18H12O3 and molecular weight 276.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyl-3-phenylnaphthalene-1,4-dione
Also Known As: 2-acetyl-3-phenylnaphthoquinone, 2-acetyl-3-phenylnaphthalene-1,4-dione, BIM-0016674.P001, 2-ACETYL-3-PHENYL-1,4-DIHYDRONAPHTHALENE-1,4-DIONE, 9-methoxy-2-methyl-7H-furo[3,2-g][1]benzopyran-7-one
| Molecular Formula | C18H12O3 |
|---|---|
| Molecular Weight | 276.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.07864 |
| Heavy Atoms | 21 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 5329-73-7 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3 |
| InChIKey | OGVDJJZWFHWTRS-UHFFFAOYSA-N |
Product Overview
2-Acetyl-3-phenylnaphthalene-1,4-dione (CAS 5329-73-7), with molecular formula C18H12O3 and molecular weight 276.08 g/mol. IUPAC: 2-acetyl-3-phenylnaphthalene-1,4-dione.
Chemical Property Profile of 2-Acetyl-3-phenylnaphthalene-1,4-dione
Property Insights of 2-Acetyl-3-phenylnaphthalene-1,4-dione
The XLogP value of 3.0 indicates that 2-Acetyl-3-phenylnaphthalene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 2-Acetyl-3-phenylnaphthalene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetyl-3-phenylnaphthalene-1,4-dione has 0 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 2-Acetyl-3-phenylnaphthalene-1,4-dione?
The CAS number of 2-Acetyl-3-phenylnaphthalene-1,4-dione is 5329-73-7.
What is the molecular formula of 2-Acetyl-3-phenylnaphthalene-1,4-dione?
The molecular formula of 2-Acetyl-3-phenylnaphthalene-1,4-dione is C18H12O3.
What is the molecular weight of 2-Acetyl-3-phenylnaphthalene-1,4-dione?
The molecular weight of 2-Acetyl-3-phenylnaphthalene-1,4-dione is 276.08 g/mol.
Where can I buy 2-Acetyl-3-phenylnaphthalene-1,4-dione?
You can request a quote for 2-Acetyl-3-phenylnaphthalene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetyl-3-phenylnaphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-3-phenylnaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.