Thiophene A
TL;DR: Thiophene A (CAS 2134-99-8) is a chemical compound with molecular formula C13H8S and molecular weight 196.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hex-5-en-1,3-diynyl-5-prop-1-ynylthiophene
Also Known As: Thiophene A, Thiophene-A, BOHLMANN K4018, 2-hex-5-en-1,3-diynyl-5-prop-1-ynylthiophene, Thiophene, 2-(5-hexene-1,3-diynyl)-5-(1-propynyl)-
| Molecular Formula | C13H8S |
|---|---|
| Molecular Weight | 196.03 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.03467 |
| Heavy Atoms | 14 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 2134-99-8 |
|---|---|
| SMILES | CC#CC1=CC=C(S1)C#CC#CC=C |
| InChIKey | CHXZRHMQQRUVHF-UHFFFAOYSA-N |
Product Overview
Thiophene A (CAS 2134-99-8), with molecular formula C13H8S and molecular weight 196.03 g/mol. IUPAC: 2-hex-5-en-1,3-diynyl-5-prop-1-ynylthiophene.
Chemical Property Profile of Thiophene A
Property Insights of Thiophene A
The XLogP value of 4.0 indicates that Thiophene A 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 A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene A 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 Thiophene A?
The CAS number of Thiophene A is 2134-99-8.
What is the molecular formula of Thiophene A?
The molecular formula of Thiophene A is C13H8S.
What is the molecular weight of Thiophene A?
The molecular weight of Thiophene A is 196.03 g/mol.
Where can I buy Thiophene A?
You can request a quote for Thiophene A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene A?
Yes, KEHONG BIO provides custom synthesis services for Thiophene A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.