5-苊烯磺酸1,2-二氢-
TL;DR: 5-苊烯磺酸1,2-二氢- (CAS 53700-79-1) is a chemical compound with molecular formula C12H10O3S and molecular weight 234.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-苊烯磺酸1,2-二氢-
1,2-dihydroacenaphthylene-5-sulfonic acid
Also Known As: 1,2-dihydroacenaphthylene-5-sulfonic acid, Acenaphthene-5-sulfonic acid, 5-Acenaphthylenesulfonic acid, 1,2-dihydro-, Acenaphthene-5-sulphonic acid, 5-Acenaphthenesulfonic acid
| Molecular Formula | C12H10O3S |
|---|---|
| Molecular Weight | 234.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.03506 |
| Heavy Atoms | 16 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 53700-79-1 |
|---|---|
| SMILES | C1CC2=CC=C(C3=CC=CC1=C23)S(=O)(=O)O |
| InChIKey | XXACHQRFXDSJNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-苊烯磺酸1,2-二氢- (CAS 53700-79-1), with molecular formula C12H10O3S and molecular weight 234.04 g/mol. IUPAC: 1,2-dihydroacenaphthylene-5-sulfonic acid.
Chemical Property Profile of 5-苊烯磺酸1,2-二氢-
Property Insights of 5-苊烯磺酸1,2-二氢-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-苊烯磺酸1,2-二氢-. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-苊烯磺酸1,2-二氢-. Following Lipinski's Rule of Five, 5-苊烯磺酸1,2-二氢- 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 5-苊烯磺酸1,2-二氢-?
The CAS number of 5-苊烯磺酸1,2-二氢- is 53700-79-1.
What is the molecular formula of 5-苊烯磺酸1,2-二氢-?
The molecular formula of 5-苊烯磺酸1,2-二氢- is C12H10O3S.
What is the molecular weight of 5-苊烯磺酸1,2-二氢-?
The molecular weight of 5-苊烯磺酸1,2-二氢- is 234.04 g/mol.
Where can I buy 5-苊烯磺酸1,2-二氢-?
You can request a quote for 5-苊烯磺酸1,2-二氢- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-苊烯磺酸1,2-二氢-?
Yes, KEHONG BIO provides custom synthesis services for 5-苊烯磺酸1,2-二氢- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.