2,5-Dibromo-3-methylthiophene
TL;DR: 2,5-Dibromo-3-methylthiophene (CAS 13191-36-1) is a chemical compound with molecular formula C5H4Br2S and molecular weight 253.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dibromo-3-methylthiophene
Also Known As: 2,5-Dibromo-3-methylthiophene, Thiophene, 2,5-dibromo-3-methyl-, Dibromo-3-methylthiophene, 2,5-dibromo-3-methyl-thiophene, 2,5-Dibrom-3-methylthiophen
| Molecular Formula | C5H4Br2S |
|---|---|
| Molecular Weight | 253.84 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 255.838 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 13191-36-1 |
|---|---|
| SMILES | CC1=C(SC(=C1)Br)Br |
| InChIKey | IHFXZROPBCBLLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dibromo-3-methylthiophene (CAS 13191-36-1), with molecular formula C5H4Br2S and molecular weight 253.84 g/mol. IUPAC: 2,5-dibromo-3-methylthiophene.
Chemical Property Profile of 2,5-Dibromo-3-methylthiophene
Property Insights of 2,5-Dibromo-3-methylthiophene
The XLogP value of 4.0 indicates that 2,5-Dibromo-3-methylthiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 2,5-Dibromo-3-methylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dibromo-3-methylthiophene 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 2,5-Dibromo-3-methylthiophene?
The CAS number of 2,5-Dibromo-3-methylthiophene is 13191-36-1.
What is the molecular formula of 2,5-Dibromo-3-methylthiophene?
The molecular formula of 2,5-Dibromo-3-methylthiophene is C5H4Br2S.
What is the molecular weight of 2,5-Dibromo-3-methylthiophene?
The molecular weight of 2,5-Dibromo-3-methylthiophene is 253.84 g/mol.
Where can I buy 2,5-Dibromo-3-methylthiophene?
You can request a quote for 2,5-Dibromo-3-methylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dibromo-3-methylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dibromo-3-methylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.