2-Octylthiophene
TL;DR: 2-Octylthiophene (CAS 880-36-4) 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-octylthiophene
Also Known As: 2-n-Octylthiophene, 2-Octylthiophene, Thiophene, 2-octyl-, octylthiophene, 7-Nitro-2(1H)-quinoxalinone
| Molecular Formula | C12H20S |
|---|---|
| Molecular Weight | 196.13 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 196.12857 |
| Heavy Atoms | 13 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 880-36-4 |
|---|---|
| SMILES | CCCCCCCCC1=CC=CS1 |
| InChIKey | GIFWAJGKWIDXMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Octylthiophene (CAS 880-36-4), with molecular formula C12H20S and molecular weight 196.13 g/mol. IUPAC: 2-octylthiophene.
Chemical Property Profile of 2-Octylthiophene
Property Insights of 2-Octylthiophene
The XLogP value of 5.5 indicates that 2-Octylthiophene 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-Octylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Octylthiophene 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-Octylthiophene?
The CAS number of 2-Octylthiophene is 880-36-4.
What is the molecular formula of 2-Octylthiophene?
The molecular formula of 2-Octylthiophene is C12H20S.
What is the molecular weight of 2-Octylthiophene?
The molecular weight of 2-Octylthiophene is 196.13 g/mol.
Where can I buy 2-Octylthiophene?
You can request a quote for 2-Octylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Octylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-Octylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.