1-Phenyl-2-(2-thienyl)-1,2-ethanedione
TL;DR: 1-Phenyl-2-(2-thienyl)-1,2-ethanedione (CAS 30135-07-0) is a chemical compound with molecular formula C12H8O2S and molecular weight 216.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-thiophen-2-ylethane-1,2-dione
Also Known As: Phenyl(2-thienyl) diketone, Ethanedione, phenyl-2-thienyl-, 1-(2-Thienyl)-2-phenylglyoxal, 2-(2-Thienyl)-1-phenylethanedione, BAS 02504707
| Molecular Formula | C12H8O2S |
|---|---|
| Molecular Weight | 216.02 g/mol |
| LogP | 2.8137 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.0245 |
| Heavy Atoms | 15 |
| Complexity | 471.58792 |
Chemical Identifiers
| CAS Number | 30135-07-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CS2 |
Product Overview
1-Phenyl-2-(2-thienyl)-1,2-ethanedione (CAS 30135-07-0), with molecular formula C12H8O2S and molecular weight 216.02 g/mol. IUPAC: 1-phenyl-2-thiophen-2-ylethane-1,2-dione.
Chemical Property Profile of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione
Property Insights of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione
The XLogP value of 2.8137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-2-(2-thienyl)-1,2-ethanedione. With a topological polar surface area (TPSA) of 34.14 Ų, 1-Phenyl-2-(2-thienyl)-1,2-ethanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-(2-thienyl)-1,2-ethanedione 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 1-Phenyl-2-(2-thienyl)-1,2-ethanedione?
The CAS number of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione is 30135-07-0.
What is the molecular formula of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione?
The molecular formula of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione is C12H8O2S.
What is the molecular weight of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione?
The molecular weight of 1-Phenyl-2-(2-thienyl)-1,2-ethanedione is 216.02 g/mol.
Where can I buy 1-Phenyl-2-(2-thienyl)-1,2-ethanedione?
You can request a quote for 1-Phenyl-2-(2-thienyl)-1,2-ethanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-(2-thienyl)-1,2-ethanedione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-(2-thienyl)-1,2-ethanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.