(3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one
TL;DR: (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one (CAS 100046-77-3) is a chemical compound with molecular formula C15H10O2S and molecular weight 254.04015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one
Also Known As: (E)-5-phenyl-3-(2-thienylmethylene)-2(3H)-furanone, (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one, 5-Phenyl-3-[1-thiophen-2-yl-meth-(E)-ylidene]-3H-furan-2-one
Technical Specifications
| Molecular Formula | C15H10O2S |
| Molecular Weight | 254.04015 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.04015 Da |
| Heavy Atoms | 18 |
| Complexity | 391.0 |
| SMILES | C1=CC=C(C=C1)C2=C/C(=C\C3=CC=CS3)/C(=O)O2 |
| InChIKey | DHSHIGJDJUERHQ-FMIVXFBMSA-N |
Chemical Property Profile of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one
Property Insights of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one
The XLogP value of 3.7 indicates that (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one?
The CAS number of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one is 100046-77-3.
What is the molecular formula of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one?
The molecular formula of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one is C15H10O2S.
What is the molecular weight of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one?
The molecular weight of (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one is 254.04015 g/mol.
Where can I buy (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one?
You can request a quote for (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one?
Yes, CoreyChem provides custom synthesis services for (3E)-5-phenyl-3-(thiophen-2-ylmethylidene)furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.