(3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one
TL;DR: (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one (CAS 152654-91-6) is a chemical compound with molecular formula C17H12O2 and molecular weight 248.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one
Also Known As: AP-782/41885347, (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one, 3-(2,3-dihydro-1H-inden-1-ylidene)-2-benzofuran-1(3H)-one, 1(3H)-Isobenzofuranone,3-(2,3-dihydro-1H-inden-1-ylidene)-,(E)- (9CI)
Technical Specifications
| Molecular Formula | C17H12O2 |
| Molecular Weight | 248.08372 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.08372 Da |
| Heavy Atoms | 19 |
| Complexity | 423.0 |
| SMILES | C1C/C(=C\2/C3=CC=CC=C3C(=O)O2)/C4=CC=CC=C41 |
| InChIKey | BOHYJZIKAWMMMF-JQIJEIRASA-N |
Chemical Property Profile of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one
Property Insights of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one
The XLogP value of 3.4 indicates that (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one 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 (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one?
The CAS number of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one is 152654-91-6.
What is the molecular formula of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one?
The molecular formula of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one is C17H12O2.
What is the molecular weight of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one?
The molecular weight of (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one is 248.08372 g/mol.
Where can I buy (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one?
You can request a quote for (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one?
Yes, CoreyChem provides custom synthesis services for (3E)-3-(2,3-dihydroinden-1-ylidene)-2-benzofuran-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.