2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-
TL;DR: 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- (CAS 51789-37-8) is a chemical compound with molecular formula C14H8O5S and molecular weight 288.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-dioxophenanthrene-2-sulfonic acid
Also Known As: Phenanthrenequinone-2-sulfonic acid, 9,10-dioxophenanthrene-2-sulfonic acid, 9,10-Dihydro-9,10-dioxo-2-phenanthrenesulfonic acid, 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-, 2-11-00-00199 (Beilstein Handbook Reference)
| Molecular Formula | C14H8O5S |
|---|---|
| Molecular Weight | 288.01 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 96.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.00925 |
| Heavy Atoms | 20 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 51789-37-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=C(C=C3)S(=O)(=O)O)C(=O)C2=O |
| InChIKey | JKQUATOWHUAGIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- (CAS 51789-37-8), with molecular formula C14H8O5S and molecular weight 288.01 g/mol. IUPAC: 9,10-dioxophenanthrene-2-sulfonic acid.
Chemical Property Profile of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-
Property Insights of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-. The TPSA of 96.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-. Following Lipinski's Rule of Five, 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- has 1 hydrogen bond donor(s) and 5 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-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-?
The CAS number of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- is 51789-37-8.
What is the molecular formula of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-?
The molecular formula of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- is C14H8O5S.
What is the molecular weight of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-?
The molecular weight of 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- is 288.01 g/mol.
Where can I buy 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-?
You can request a quote for 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo-?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenanthrenesulfonic acid, 9,10-dihydro-9,10-dioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.