2(3H)-Thiophenone, dihydro-
TL;DR: 2(3H)-Thiophenone, dihydro- (CAS 1003-10-7) is a chemical compound with molecular formula C4H6OS and molecular weight 102.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thiolan-2-one
Also Known As: Thiolan-2-one, 4-Butyrothiolactone, gamma-Thiobutyrolactone, Dihydro-2(3H)-thiophenone, 2-Oxothiolane
| Molecular Formula | C4H6OS |
|---|---|
| Molecular Weight | 102.01 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 102.01394 |
| Heavy Atoms | 6 |
| Complexity | 69.0 |
| Boiling Point | 195.00 to 197.00 °C. @ 760.00 mm Hg |
| Density | 1.175-1.185 (20°) |
| Solubility | Practically insoluble or insoluble in water |
| Refractive Index | 1.518-1.528 |
Chemical Identifiers
| CAS Number | 1003-10-7 |
|---|---|
| SMILES | C1CC(=O)SC1 |
| InChIKey | KMSNYNIWEORQDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2(3H)-Thiophenone, dihydro- (CAS 1003-10-7), with molecular formula C4H6OS and molecular weight 102.01 g/mol. IUPAC: thiolan-2-one.
Chemical Property Profile of 2(3H)-Thiophenone, dihydro-
Property Insights of 2(3H)-Thiophenone, dihydro-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Thiophenone, dihydro-. With a topological polar surface area (TPSA) of 42.4 Ų, 2(3H)-Thiophenone, dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Thiophenone, dihydro- 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, dihydro-?
The CAS number of 2(3H)-Thiophenone, dihydro- is 1003-10-7.
What is the molecular formula of 2(3H)-Thiophenone, dihydro-?
The molecular formula of 2(3H)-Thiophenone, dihydro- is C4H6OS.
What is the molecular weight of 2(3H)-Thiophenone, dihydro-?
The molecular weight of 2(3H)-Thiophenone, dihydro- is 102.01 g/mol.
Where can I buy 2(3H)-Thiophenone, dihydro-?
You can request a quote for 2(3H)-Thiophenone, dihydro- 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, dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Thiophenone, dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.