TL;DR: Oxazole, dihydro(1-methylethenyl)- (CAS 125062-15-9) is a chemical compound with molecular formula C6H9NO and molecular weight 111.06841 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-prop-1-en-2-yl-2,3-dihydro-1,3-oxazole
Also Known As: Oxazole, dihydro(1-methylethenyl)-, Oxazole,dihydro(1-methylethenyl), 2-prop-1-en-2-yl-2,3-dihydro-1,3-oxazole, 2-(prop-1-en-2-yl)-2,3-dihydro-1,3-oxazole
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H9NO |
| Molecular Weight | 111.06841 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 111.06841 Da |
| Heavy Atoms | 8 |
| Complexity | 128.0 |
| SMILES | CC(=C)C1NC=CO1 |
| InChIKey | VEWHXOVRFRYMDZ-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxazole, dihydro(1-methylethenyl)-. With a topological polar surface area (TPSA) of 21.3 Ų, Oxazole, dihydro(1-methylethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazole, dihydro(1-methylethenyl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Oxazole, dihydro(1-methylethenyl)- is 125062-15-9.
The molecular formula of Oxazole, dihydro(1-methylethenyl)- is C6H9NO.
The molecular weight of Oxazole, dihydro(1-methylethenyl)- is 111.06841 g/mol.
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