TL;DR: 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- (CAS 111052-70-1) is a chemical compound with molecular formula C18H24O3 and molecular weight 288.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)chromen-2-one
Also Known As: 3-Butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)-, 3-butyl-7-hydroxy-6-isobutyl-4-methyl-2H-chromen-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)chromen-2-one
| Molecular Formula | C18H24O3 |
| Molecular Weight | 288.17255 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.17255 Da |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
| SMILES | CCCCC1=C(C2=C(C=C(C(=C2)CC(C)C)O)OC1=O)C |
| InChIKey | CGZUKBMXSMLZHX-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- has 1 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 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- is 111052-70-1.
The molecular formula of 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- is C18H24O3.
The molecular weight of 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- is 288.17255 g/mol.
You can request a quote for 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for 2H-1-Benzopyran-2-one, 3-butyl-7-hydroxy-4-methyl-6-(2-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 111052-70-1. Our professional technical team will respond with pricing and lead time.