2-(2-Thiophen-2-ylethenyl)benzoic acid
TL;DR: 2-(2-Thiophen-2-ylethenyl)benzoic acid (CAS 1966-89-8) is a chemical compound with molecular formula C13H10O2S and molecular weight 230.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-thiophen-2-ylethenyl)benzoic acid
Also Known As: Maybridge1_005697, 2-(2-thiophen-2-ylethenyl)benzoic acid, DivK1c_001985, 2-[2-(thienyl)vinyl]benzoic acid, 2-(b-(2-Thienyl)vinyl)benzoicacid
| Molecular Formula | C13H10O2S |
|---|---|
| Molecular Weight | 230.04 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.04015 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 1966-89-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC2=CC=CS2)C(=O)O |
| InChIKey | ISSJZCAENPGUEW-UHFFFAOYSA-N |
Product Overview
2-(2-Thiophen-2-ylethenyl)benzoic acid (CAS 1966-89-8), with molecular formula C13H10O2S and molecular weight 230.04 g/mol. IUPAC: 2-(2-thiophen-2-ylethenyl)benzoic acid.
Chemical Property Profile of 2-(2-Thiophen-2-ylethenyl)benzoic acid
Property Insights of 2-(2-Thiophen-2-ylethenyl)benzoic acid
The XLogP value of 3.4 indicates that 2-(2-Thiophen-2-ylethenyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Thiophen-2-ylethenyl)benzoic acid. Following Lipinski's Rule of Five, 2-(2-Thiophen-2-ylethenyl)benzoic acid has 1 hydrogen bond donor(s) and 3 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-(2-Thiophen-2-ylethenyl)benzoic acid?
The CAS number of 2-(2-Thiophen-2-ylethenyl)benzoic acid is 1966-89-8.
What is the molecular formula of 2-(2-Thiophen-2-ylethenyl)benzoic acid?
The molecular formula of 2-(2-Thiophen-2-ylethenyl)benzoic acid is C13H10O2S.
What is the molecular weight of 2-(2-Thiophen-2-ylethenyl)benzoic acid?
The molecular weight of 2-(2-Thiophen-2-ylethenyl)benzoic acid is 230.04 g/mol.
Where can I buy 2-(2-Thiophen-2-ylethenyl)benzoic acid?
You can request a quote for 2-(2-Thiophen-2-ylethenyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Thiophen-2-ylethenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Thiophen-2-ylethenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.