5,8-Dioxonaphthalene-1-carbaldehyde
TL;DR: 5,8-Dioxonaphthalene-1-carbaldehyde (CAS 76916-88-6) is a chemical compound with molecular formula C11H6O3 and molecular weight 186.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8-dioxonaphthalene-1-carbaldehyde
Also Known As: 5,8-dioxonaphthalene-1-carbaldehyde, 5,8-Dioxo-5,8-dihydro-1-naphthaldehyde, 5,8-dioxo-5,8-dihydronaphthalene-1-carbaldehyde, J1.761.458D
| Molecular Formula | C11H6O3 |
|---|---|
| Molecular Weight | 186.03 g/mol |
| LogP | 1.4343 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.0317 |
| Heavy Atoms | 14 |
| Complexity | 469.42102 |
Chemical Identifiers
| CAS Number | 76916-88-6 |
|---|---|
| SMILES | C1=CC(=C2C(=O)C=CC(=O)C2=C1)C=O |
Product Overview
5,8-Dioxonaphthalene-1-carbaldehyde (CAS 76916-88-6), with molecular formula C11H6O3 and molecular weight 186.03 g/mol. IUPAC: 5,8-dioxonaphthalene-1-carbaldehyde.
Chemical Property Profile of 5,8-Dioxonaphthalene-1-carbaldehyde
Property Insights of 5,8-Dioxonaphthalene-1-carbaldehyde
The XLogP value of 1.4343 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8-Dioxonaphthalene-1-carbaldehyde. With a topological polar surface area (TPSA) of 51.21 Ų, 5,8-Dioxonaphthalene-1-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Dioxonaphthalene-1-carbaldehyde 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 5,8-Dioxonaphthalene-1-carbaldehyde?
The CAS number of 5,8-Dioxonaphthalene-1-carbaldehyde is 76916-88-6.
What is the molecular formula of 5,8-Dioxonaphthalene-1-carbaldehyde?
The molecular formula of 5,8-Dioxonaphthalene-1-carbaldehyde is C11H6O3.
What is the molecular weight of 5,8-Dioxonaphthalene-1-carbaldehyde?
The molecular weight of 5,8-Dioxonaphthalene-1-carbaldehyde is 186.03 g/mol.
Where can I buy 5,8-Dioxonaphthalene-1-carbaldehyde?
You can request a quote for 5,8-Dioxonaphthalene-1-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8-Dioxonaphthalene-1-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5,8-Dioxonaphthalene-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.