TL;DR: 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- (CAS 27850-28-8) is a chemical compound with molecular formula C15H16O3 and molecular weight 244.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-5-(prop-2-ynoxymethyl)oxolan-2-one
Also Known As: Dihydro-3-benzyl-5-(2-propynyloxymethyl)-2(3H)-furanone, Propargyloxymethyl-4 benzyl-2 gamma-butyrolactone, 4,5-dihydro-3-5-[methyl]-2 -furanone, 3-benzyl-5-(prop-2-ynoxymethyl)oxolan-2-one, 4,5-Dihydro-3- -5-[ methyl]-2 -furanone
| Molecular Formula | C15H16O3 |
| Molecular Weight | 244.10994 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 244.10994 Da |
| Heavy Atoms | 18 |
| Complexity | 322.0 |
| SMILES | C#CCOCC1CC(C(=O)O1)CC2=CC=CC=C2 |
| InChIKey | RHWOEAYQQXPUEM-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)-. With a topological polar surface area (TPSA) of 35.5 Ų, 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- 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 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- is 27850-28-8.
The molecular formula of 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- is C15H16O3.
The molecular weight of 2(3H)-Furanone, dihydro-3-benzyl-5-(2-propynyloxymethyl)- is 244.10994 g/mol.
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