2,3-Naphthalenediol diacetate
TL;DR: 2,3-Naphthalenediol diacetate (CAS 22426-46-6) is a chemical compound with molecular formula C14H12O4 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxynaphthalen-2-yl) acetate
Also Known As: 2,3-Naphthalenediol diacetate, 2,3-diacetoxynaphthalene, 2,3-Diacetoxy-naphthalin, 2,3-Naphthylene=diacetate, 2,3-Naphthalenediol,diacetate
| Molecular Formula | C14H12O4 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.07356 |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 22426-46-6 |
|---|---|
| SMILES | CC(=O)OC1=CC2=CC=CC=C2C=C1OC(=O)C |
| InChIKey | CNUNETLANGTFDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Naphthalenediol diacetate (CAS 22426-46-6), with molecular formula C14H12O4 and molecular weight 244.07 g/mol. IUPAC: (3-acetyloxynaphthalen-2-yl) acetate.
Chemical Property Profile of 2,3-Naphthalenediol diacetate
Property Insights of 2,3-Naphthalenediol diacetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Naphthalenediol diacetate. With a topological polar surface area (TPSA) of 52.6 Ų, 2,3-Naphthalenediol diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Naphthalenediol diacetate has 0 hydrogen bond donor(s) and 4 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 2,3-Naphthalenediol diacetate?
The CAS number of 2,3-Naphthalenediol diacetate is 22426-46-6.
What is the molecular formula of 2,3-Naphthalenediol diacetate?
The molecular formula of 2,3-Naphthalenediol diacetate is C14H12O4.
What is the molecular weight of 2,3-Naphthalenediol diacetate?
The molecular weight of 2,3-Naphthalenediol diacetate is 244.07 g/mol.
Where can I buy 2,3-Naphthalenediol diacetate?
You can request a quote for 2,3-Naphthalenediol diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Naphthalenediol diacetate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Naphthalenediol diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.