2,5-Diheptylthiophene
TL;DR: 2,5-Diheptylthiophene (CAS 4806-14-8) is a chemical compound with molecular formula C18H32S and molecular weight 280.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diheptylthiophene
Also Known As: 2,5-Diheptylthiophene, Thiophene, 2,5-diheptyl-, 2,5-Diheptylthiophene #
| Molecular Formula | C18H32S |
|---|---|
| Molecular Weight | 280.22 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 280.22247 |
| Heavy Atoms | 19 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 4806-14-8 |
|---|---|
| SMILES | CCCCCCCC1=CC=C(S1)CCCCCCC |
| InChIKey | OZFLBWDMZPGSHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Diheptylthiophene (CAS 4806-14-8), with molecular formula C18H32S and molecular weight 280.22 g/mol. IUPAC: 2,5-diheptylthiophene.
Chemical Property Profile of 2,5-Diheptylthiophene
Property Insights of 2,5-Diheptylthiophene
The XLogP value of 8.3 indicates that 2,5-Diheptylthiophene 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-Diheptylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Diheptylthiophene 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 2,5-Diheptylthiophene?
The CAS number of 2,5-Diheptylthiophene is 4806-14-8.
What is the molecular formula of 2,5-Diheptylthiophene?
The molecular formula of 2,5-Diheptylthiophene is C18H32S.
What is the molecular weight of 2,5-Diheptylthiophene?
The molecular weight of 2,5-Diheptylthiophene is 280.22 g/mol.
Where can I buy 2,5-Diheptylthiophene?
You can request a quote for 2,5-Diheptylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diheptylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diheptylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.