3,4-Dimethylthiophene
TL;DR: 3,4-Dimethylthiophene (CAS 632-15-5) is a chemical compound with molecular formula C6H8S and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethylthiophene
Also Known As: 3,4-Dimethylthiophene, Thiophene, 3,4-dimethyl-, 3,4-dimethyl-thiophene, 3,4-dimethyl thiophene, Thiophene,3,4-dimethyl-
| Molecular Formula | C6H8S |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.03467 |
| Heavy Atoms | 7 |
| Complexity | 53.0 |
| Boiling Point | 144.00 to 146.00 °C. @ 760.00 mm Hg |
| Density | 1.002-1.008 (20°) |
| Solubility | Practically insoluble to insoluble in water |
| Refractive Index | 1.517-1.523 |
Chemical Identifiers
| CAS Number | 632-15-5 |
|---|---|
| SMILES | CC1=CSC=C1C |
| InChIKey | GPSFYJDZKSRMKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dimethylthiophene (CAS 632-15-5), with molecular formula C6H8S and molecular weight 112.03 g/mol. IUPAC: 3,4-dimethylthiophene.
Chemical Property Profile of 3,4-Dimethylthiophene
Property Insights of 3,4-Dimethylthiophene
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethylthiophene. With a topological polar surface area (TPSA) of 28.2 Ų, 3,4-Dimethylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethylthiophene has 0 hydrogen bond donor(s) and 1 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 3,4-Dimethylthiophene?
The CAS number of 3,4-Dimethylthiophene is 632-15-5.
What is the molecular formula of 3,4-Dimethylthiophene?
The molecular formula of 3,4-Dimethylthiophene is C6H8S.
What is the molecular weight of 3,4-Dimethylthiophene?
The molecular weight of 3,4-Dimethylthiophene is 112.03 g/mol.
Where can I buy 3,4-Dimethylthiophene?
You can request a quote for 3,4-Dimethylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.