1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone
TL;DR: 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone (CAS 4711-62-0) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-acetyl-4-hydroxynaphthalen-1-yl)ethanone
Also Known As: 1,1'-(4-hydroxynaphthalene-1,3-diyl)diethanone, 1,6-Diimino-2,4-cyclohexadiene, KST-1B5262, 1-(3-acetyl-4-hydroxynaphthalen-1-yl)ethanone, 1-(3-acetyl-4-hydroxynaphthalen-1-yl)ethan-1-one
| Molecular Formula | C14H12O3 |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.07864 |
| Heavy Atoms | 17 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 4711-62-0 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C2=CC=CC=C21)O)C(=O)C |
| InChIKey | LCSMZQPYTFSOJD-UHFFFAOYSA-N |
Product Overview
1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone (CAS 4711-62-0), with molecular formula C14H12O3 and molecular weight 228.08 g/mol. IUPAC: 1-(3-acetyl-4-hydroxynaphthalen-1-yl)ethanone.
Chemical Property Profile of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone
Property Insights of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone. With a topological polar surface area (TPSA) of 54.4 Ų, 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone 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 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone?
The CAS number of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone is 4711-62-0.
What is the molecular formula of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone?
The molecular formula of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone is C14H12O3.
What is the molecular weight of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone?
The molecular weight of 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone is 228.08 g/mol.
Where can I buy 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone?
You can request a quote for 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(4-Hydroxynaphthalene-1,3-diyl)diethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.