Ethanone, 1-(2-thianthrenyl)-
TL;DR: Ethanone, 1-(2-thianthrenyl)- (CAS 14812-64-7) is a chemical compound with molecular formula C14H10OS2 and molecular weight 258.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-thianthren-2-ylethanone
Also Known As: 2-acetylthianthrene, Ethanone, 1-(2-thianthrenyl)-, 1-thianthren-2-ylethanone, 1-(THIANTHREN-2-YL)ETHAN-1-ONE, RefChem:341117
| Molecular Formula | C14H10OS2 |
|---|---|
| Molecular Weight | 258.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.0173 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 14812-64-7 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3S2 |
| InChIKey | XLKTXBRNWCHYAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(2-thianthrenyl)- (CAS 14812-64-7), with molecular formula C14H10OS2 and molecular weight 258.02 g/mol. IUPAC: 1-thianthren-2-ylethanone.
Chemical Property Profile of Ethanone, 1-(2-thianthrenyl)-
Property Insights of Ethanone, 1-(2-thianthrenyl)-
The XLogP value of 3.8 indicates that Ethanone, 1-(2-thianthrenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(2-thianthrenyl)-. Following Lipinski's Rule of Five, Ethanone, 1-(2-thianthrenyl)- 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 Ethanone, 1-(2-thianthrenyl)-?
The CAS number of Ethanone, 1-(2-thianthrenyl)- is 14812-64-7.
What is the molecular formula of Ethanone, 1-(2-thianthrenyl)-?
The molecular formula of Ethanone, 1-(2-thianthrenyl)- is C14H10OS2.
What is the molecular weight of Ethanone, 1-(2-thianthrenyl)-?
The molecular weight of Ethanone, 1-(2-thianthrenyl)- is 258.02 g/mol.
Where can I buy Ethanone, 1-(2-thianthrenyl)-?
You can request a quote for Ethanone, 1-(2-thianthrenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(2-thianthrenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(2-thianthrenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.