9,10-Anthracenedione, 1-(phenylthio)-
TL;DR: 9,10-Anthracenedione, 1-(phenylthio)- (CAS 13354-35-3) is a chemical compound with molecular formula C20H12O2S and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylsulfanylanthracene-9,10-dione
Also Known As: 1-(Phenylthio)anthraquinone, 1-Thiophenylanthraquinone, Anthraquinone, 1-thiophenyl, Solvent yellow 167, 1-Phenylthio-9,10-anthracenedione
| Molecular Formula | C20H12O2S |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.0558 |
| Heavy Atoms | 23 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 13354-35-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O |
| InChIKey | FPRGJFFNVANESG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Anthracenedione, 1-(phenylthio)- (CAS 13354-35-3), with molecular formula C20H12O2S and molecular weight 316.06 g/mol. IUPAC: 1-phenylsulfanylanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-(phenylthio)-
Property Insights of 9,10-Anthracenedione, 1-(phenylthio)-
The XLogP value of 5.4 indicates that 9,10-Anthracenedione, 1-(phenylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.4 Ų, 9,10-Anthracenedione, 1-(phenylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-(phenylthio)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9,10-Anthracenedione, 1-(phenylthio)-?
The CAS number of 9,10-Anthracenedione, 1-(phenylthio)- is 13354-35-3.
What is the molecular formula of 9,10-Anthracenedione, 1-(phenylthio)-?
The molecular formula of 9,10-Anthracenedione, 1-(phenylthio)- is C20H12O2S.
What is the molecular weight of 9,10-Anthracenedione, 1-(phenylthio)-?
The molecular weight of 9,10-Anthracenedione, 1-(phenylthio)- is 316.06 g/mol.
Where can I buy 9,10-Anthracenedione, 1-(phenylthio)-?
You can request a quote for 9,10-Anthracenedione, 1-(phenylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1-(phenylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-(phenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.