2(3H)-Thiophenone, 5-phenyl-
TL;DR: 2(3H)-Thiophenone, 5-phenyl- (CAS 939-09-3) is a chemical compound with molecular formula C10H8OS and molecular weight 176.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-3H-thiophen-2-one
Also Known As: 5-phenyl-3H-thiophen-2-one, 2(3H)-Thiophenone, 5-phenyl-, 5-phenylthiophen-2(3H)-one, 5-Phenyl-2(3H)-thiophenone, 2(3H)-Thiophenone,5-phenyl
| Molecular Formula | C10H8OS |
|---|---|
| Molecular Weight | 176.03 g/mol |
| LogP | 2.691 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.02959 |
| Heavy Atoms | 12 |
| Complexity | 326.95163 |
Chemical Identifiers
| CAS Number | 939-09-3 |
|---|---|
| SMILES | C1C=C(SC1=O)C2=CC=CC=C2 |
Product Overview
2(3H)-Thiophenone, 5-phenyl- (CAS 939-09-3), with molecular formula C10H8OS and molecular weight 176.03 g/mol. IUPAC: 5-phenyl-3H-thiophen-2-one.
Chemical Property Profile of 2(3H)-Thiophenone, 5-phenyl-
Property Insights of 2(3H)-Thiophenone, 5-phenyl-
The XLogP value of 2.691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Thiophenone, 5-phenyl-. With a topological polar surface area (TPSA) of 17.07 Ų, 2(3H)-Thiophenone, 5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Thiophenone, 5-phenyl- has 0 hydrogen bond donor(s) and 2 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 2(3H)-Thiophenone, 5-phenyl-?
The CAS number of 2(3H)-Thiophenone, 5-phenyl- is 939-09-3.
What is the molecular formula of 2(3H)-Thiophenone, 5-phenyl-?
The molecular formula of 2(3H)-Thiophenone, 5-phenyl- is C10H8OS.
What is the molecular weight of 2(3H)-Thiophenone, 5-phenyl-?
The molecular weight of 2(3H)-Thiophenone, 5-phenyl- is 176.03 g/mol.
Where can I buy 2(3H)-Thiophenone, 5-phenyl-?
You can request a quote for 2(3H)-Thiophenone, 5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Thiophenone, 5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Thiophenone, 5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.