3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one
TL;DR: 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one (CAS 376381-25-8) is a chemical compound with molecular formula C20H26O4 and molecular weight 330.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one
Also Known As: 3-hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one, 3-hexyl-4-methyl-7-(1-methyl-2-oxopropoxy)-2H-chromen-2-one, 3-hexyl-4-methyl-7-[(3-oxobutan-2-yl)oxy]-2H-chromen-2-one, 3-hexyl-4-methyl-7-((3-oxobutan-2-yl)oxy)-2H-chromen-2-one
| Molecular Formula | C20H26O4 |
|---|---|
| Molecular Weight | 330.18 g/mol |
| LogP | 4.58052 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 330.1831 |
| Heavy Atoms | 24 |
| Complexity | 773.0379 |
Chemical Identifiers
| CAS Number | 376381-25-8 |
|---|---|
| SMILES | CCCCCCC1=C(C2=C(C=C(C=C2)OC(C)C(=O)C)OC1=O)C |
Product Overview
3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one (CAS 376381-25-8), with molecular formula C20H26O4 and molecular weight 330.18 g/mol. IUPAC: 3-hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one.
Chemical Property Profile of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one
Property Insights of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one
The XLogP value of 4.58052 indicates that 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one?
The CAS number of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one is 376381-25-8.
What is the molecular formula of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one?
The molecular formula of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one is C20H26O4.
What is the molecular weight of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one?
The molecular weight of 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one is 330.18 g/mol.
Where can I buy 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one?
You can request a quote for 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hexyl-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.