1,2,3,4-Naphthalenetetrone
TL;DR: 1,2,3,4-Naphthalenetetrone (CAS 30267-44-8) is a chemical compound with molecular formula C10H4O4 and molecular weight 188.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalene-1,2,3,4-tetrone
Also Known As: 1,2,3,4-Naphthalenetetrone, Oxoline, Oksolin, oxolin, Oxaline
| Molecular Formula | C10H4O4 |
|---|---|
| Molecular Weight | 188.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.01096 |
| Heavy Atoms | 14 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 30267-44-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=O)C(=O)C2=O |
| InChIKey | HZVGIXIRNANSHU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4-Naphthalenetetrone (CAS 30267-44-8), with molecular formula C10H4O4 and molecular weight 188.01 g/mol. IUPAC: naphthalene-1,2,3,4-tetrone.
Chemical Property Profile of 1,2,3,4-Naphthalenetetrone
Property Insights of 1,2,3,4-Naphthalenetetrone
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-Naphthalenetetrone. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Naphthalenetetrone. Following Lipinski's Rule of Five, 1,2,3,4-Naphthalenetetrone 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 1,2,3,4-Naphthalenetetrone?
The CAS number of 1,2,3,4-Naphthalenetetrone is 30267-44-8.
What is the molecular formula of 1,2,3,4-Naphthalenetetrone?
The molecular formula of 1,2,3,4-Naphthalenetetrone is C10H4O4.
What is the molecular weight of 1,2,3,4-Naphthalenetetrone?
The molecular weight of 1,2,3,4-Naphthalenetetrone is 188.01 g/mol.
Where can I buy 1,2,3,4-Naphthalenetetrone?
You can request a quote for 1,2,3,4-Naphthalenetetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Naphthalenetetrone?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Naphthalenetetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.