TL;DR: (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one (CAS 111042-61-6) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one
Also Known As: BAS 00791996, 1-Furan-2-yl-3-(2-methoxy-phenyl)-propenone, J3.193.530J, (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one, 1-(2-Furanyl)-3-(2-methoxyphenyl)-2-propene-1-one
| Molecular Formula | C14H12O3 |
| Molecular Weight | 228.07864 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.07864 Da |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
| SMILES | COC1=CC=CC=C1/C=C/C(=O)C2=CC=CO2 |
| InChIKey | SCAUJAJEOISLKB-CMDGGOBGSA-N |
The XLogP value of 3.1 indicates that (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one is 111042-61-6.
The molecular formula of (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one is C14H12O3.
The molecular weight of (2E)-1-(Furan-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one is 228.07864 g/mol.
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