Thiophene, 2,5-dibutyl-
TL;DR: Thiophene, 2,5-dibutyl- (CAS 6911-45-1) is a chemical compound with molecular formula C12H20S and molecular weight 196.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dibutylthiophene
Also Known As: 2,5-Dibutylthiophene, Thiophene, 2,5-dibutyl-, 2,5-Dibutylthiophene #
| Molecular Formula | C12H20S |
|---|---|
| Molecular Weight | 196.13 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 196.12857 |
| Heavy Atoms | 13 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 6911-45-1 |
|---|---|
| SMILES | CCCCC1=CC=C(S1)CCCC |
| InChIKey | NHLXPPMDOYFYFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiophene, 2,5-dibutyl- (CAS 6911-45-1), with molecular formula C12H20S and molecular weight 196.13 g/mol. IUPAC: 2,5-dibutylthiophene.
Chemical Property Profile of Thiophene, 2,5-dibutyl-
Property Insights of Thiophene, 2,5-dibutyl-
The XLogP value of 5.1 indicates that Thiophene, 2,5-dibutyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Thiophene, 2,5-dibutyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, 2,5-dibutyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thiophene, 2,5-dibutyl-?
The CAS number of Thiophene, 2,5-dibutyl- is 6911-45-1.
What is the molecular formula of Thiophene, 2,5-dibutyl-?
The molecular formula of Thiophene, 2,5-dibutyl- is C12H20S.
What is the molecular weight of Thiophene, 2,5-dibutyl-?
The molecular weight of Thiophene, 2,5-dibutyl- is 196.13 g/mol.
Where can I buy Thiophene, 2,5-dibutyl-?
You can request a quote for Thiophene, 2,5-dibutyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene, 2,5-dibutyl-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, 2,5-dibutyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.