2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-
TL;DR: 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- (CAS 111052-53-0) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,7-dihydroxy-4-methyl-3-propylchromen-2-one
Also Known As: 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-, 5,7-dihydroxy-4-methyl-3-propyl-2H-chromen-2-one, 5,7-Dihydroxy-4-methyl-3-propyl-2H-1-benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propylchromen-2-one, AE-641/12195068
Technical Specifications
| Molecular Formula | C13H14O4 |
| Molecular Weight | 234.0892 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0892 Da |
| Heavy Atoms | 17 |
| Complexity | 347.0 |
| SMILES | CCCC1=C(C2=C(C=C(C=C2OC1=O)O)O)C |
| InChIKey | ULUBXAPSIALREU-UHFFFAOYSA-N |
Chemical Property Profile of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-
Property Insights of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-?
The CAS number of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- is 111052-53-0.
What is the molecular formula of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-?
The molecular formula of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- is C13H14O4.
What is the molecular weight of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-?
The molecular weight of 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- is 234.0892 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-?
You can request a quote for 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl-?
Yes, CoreyChem provides custom synthesis services for 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.