Dihydro-5-methyl-2(3H)-thiophenone
TL;DR: Dihydro-5-methyl-2(3H)-thiophenone (CAS 5650-74-8) is a chemical compound with molecular formula C5H8OS and molecular weight 116.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylthiolan-2-one
Also Known As: 5-methylthiolan-2-one, Dihydro-5-methyl-2(3H)-thiophenone, 5-Methyltetrahydrothiophen-2-one, 5-Methyl-g-thiobutyrolactone, 5-Methyldihydrothiophen-2(3H)-one
| Molecular Formula | C5H8OS |
|---|---|
| Molecular Weight | 116.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.02959 |
| Heavy Atoms | 7 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 5650-74-8 |
|---|---|
| SMILES | CC1CCC(=O)S1 |
| InChIKey | BNHNVGAUODLKKT-UHFFFAOYSA-N |
Product Overview
Dihydro-5-methyl-2(3H)-thiophenone (CAS 5650-74-8), with molecular formula C5H8OS and molecular weight 116.03 g/mol. IUPAC: 5-methylthiolan-2-one.
Chemical Property Profile of Dihydro-5-methyl-2(3H)-thiophenone
Property Insights of Dihydro-5-methyl-2(3H)-thiophenone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydro-5-methyl-2(3H)-thiophenone. With a topological polar surface area (TPSA) of 42.4 Ų, Dihydro-5-methyl-2(3H)-thiophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydro-5-methyl-2(3H)-thiophenone 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 Dihydro-5-methyl-2(3H)-thiophenone?
The CAS number of Dihydro-5-methyl-2(3H)-thiophenone is 5650-74-8.
What is the molecular formula of Dihydro-5-methyl-2(3H)-thiophenone?
The molecular formula of Dihydro-5-methyl-2(3H)-thiophenone is C5H8OS.
What is the molecular weight of Dihydro-5-methyl-2(3H)-thiophenone?
The molecular weight of Dihydro-5-methyl-2(3H)-thiophenone is 116.03 g/mol.
Where can I buy Dihydro-5-methyl-2(3H)-thiophenone?
You can request a quote for Dihydro-5-methyl-2(3H)-thiophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydro-5-methyl-2(3H)-thiophenone?
Yes, KEHONG BIO provides custom synthesis services for Dihydro-5-methyl-2(3H)-thiophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.