3-Iodo-2,5-dimethylthiophene
TL;DR: 3-Iodo-2,5-dimethylthiophene (CAS 40197-02-2) is a chemical compound with molecular formula C6H7IS and molecular weight 237.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-2,5-dimethylthiophene
Also Known As: 3-iodo-2,5-dimethylthiophene, 3-iodo-2,5-dimethyl-thiophene, 3-iodo-25-diMethylthiophene, 2,5-Dimethyl-4-iodothiophene, 3-Jod-2,5-dimethyl-thiophen
| Molecular Formula | C6H7IS |
|---|---|
| Molecular Weight | 237.93 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.93132 |
| Heavy Atoms | 8 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 40197-02-2 |
|---|---|
| SMILES | CC1=CC(=C(S1)C)I |
| InChIKey | SHOXGOWAOZUVEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Iodo-2,5-dimethylthiophene (CAS 40197-02-2), with molecular formula C6H7IS and molecular weight 237.93 g/mol. IUPAC: 3-iodo-2,5-dimethylthiophene.
Chemical Property Profile of 3-Iodo-2,5-dimethylthiophene
Property Insights of 3-Iodo-2,5-dimethylthiophene
The XLogP value of 3.1 indicates that 3-Iodo-2,5-dimethylthiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 3-Iodo-2,5-dimethylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Iodo-2,5-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-Iodo-2,5-dimethylthiophene?
The CAS number of 3-Iodo-2,5-dimethylthiophene is 40197-02-2.
What is the molecular formula of 3-Iodo-2,5-dimethylthiophene?
The molecular formula of 3-Iodo-2,5-dimethylthiophene is C6H7IS.
What is the molecular weight of 3-Iodo-2,5-dimethylthiophene?
The molecular weight of 3-Iodo-2,5-dimethylthiophene is 237.93 g/mol.
Where can I buy 3-Iodo-2,5-dimethylthiophene?
You can request a quote for 3-Iodo-2,5-dimethylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Iodo-2,5-dimethylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 3-Iodo-2,5-dimethylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.