3-(Thiophen-3-yl)benzaldehyde
TL;DR: 3-(Thiophen-3-yl)benzaldehyde (CAS 129746-42-5) is a chemical compound with molecular formula C11H8OS and molecular weight 188.02959 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-thiophen-3-ylbenzaldehyde
Also Known As: 3-(thiophen-3-yl)benzaldehyde, 3-thien-3-ylbenzaldehyde, 3-thiophen-3-ylbenzaldehyde, 3-(3-thienyl)benzaldehyde, Benzaldehyde, 3-(3-thienyl)-
Technical Specifications
| Molecular Formula | C11H8OS |
| Molecular Weight | 188.02959 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.02959 Da |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
| SMILES | C1=CC(=CC(=C1)C2=CSC=C2)C=O |
| InChIKey | HOQKGZHXQLZFBT-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Thiophen-3-yl)benzaldehyde
Property Insights of 3-(Thiophen-3-yl)benzaldehyde
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Thiophen-3-yl)benzaldehyde. With a topological polar surface area (TPSA) of 45.3 Ų, 3-(Thiophen-3-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Thiophen-3-yl)benzaldehyde has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Thiophen-3-yl)benzaldehyde?
The CAS number of 3-(Thiophen-3-yl)benzaldehyde is 129746-42-5.
What is the molecular formula of 3-(Thiophen-3-yl)benzaldehyde?
The molecular formula of 3-(Thiophen-3-yl)benzaldehyde is C11H8OS.
What is the molecular weight of 3-(Thiophen-3-yl)benzaldehyde?
The molecular weight of 3-(Thiophen-3-yl)benzaldehyde is 188.02959 g/mol.
Where can I buy 3-(Thiophen-3-yl)benzaldehyde?
You can request a quote for 3-(Thiophen-3-yl)benzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Thiophen-3-yl)benzaldehyde?
Yes, CoreyChem provides custom synthesis services for 3-(Thiophen-3-yl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.