1-芘磺酸
TL;DR: 1-芘磺酸 (CAS 26651-23-0) is a chemical compound with molecular formula C16H10O3S and molecular weight 282.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-芘磺酸
pyrene-1-sulfonic acid
Also Known As: 1-Pyrenesulfonic acid, Pyrene-1-sulfonic acid, Pyrene-3-sulfonic acid, pyrenesulfonic acid, pyrene-1-sulfonicacid
| Molecular Formula | C16H10O3S |
|---|---|
| Molecular Weight | 282.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.03506 |
| Heavy Atoms | 20 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 26651-23-0 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)S(=O)(=O)O |
| InChIKey | DLOBKMWCBFOUHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-芘磺酸 (CAS 26651-23-0), with molecular formula C16H10O3S and molecular weight 282.04 g/mol. IUPAC: pyrene-1-sulfonic acid.
Chemical Property Profile of 1-芘磺酸
Property Insights of 1-芘磺酸
The XLogP value of 3.8 indicates that 1-芘磺酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-芘磺酸. Following Lipinski's Rule of Five, 1-芘磺酸 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-芘磺酸?
The CAS number of 1-芘磺酸 is 26651-23-0.
What is the molecular formula of 1-芘磺酸?
The molecular formula of 1-芘磺酸 is C16H10O3S.
What is the molecular weight of 1-芘磺酸?
The molecular weight of 1-芘磺酸 is 282.04 g/mol.
Where can I buy 1-芘磺酸?
You can request a quote for 1-芘磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-芘磺酸?
Yes, KEHONG BIO provides custom synthesis services for 1-芘磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.