6-Hexyl-4-methyl-7-hydroxycumarin
TL;DR: 6-Hexyl-4-methyl-7-hydroxycumarin (CAS 75908-57-5) is a chemical compound with molecular formula C16H20O3 and molecular weight 260.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hexyl-7-hydroxy-4-methylchromen-2-one
Also Known As: Maybridge1_001950, 6-hexyl-4-methyl-7-hydroxycumarin, BTB 10067, 6-hexyl-7-hydroxy-4-methylchromen-2-one, 6-hexyl-7-hydroxy-4-methyl-2H-chromen-2-one
| Molecular Formula | C16H20O3 |
|---|---|
| Molecular Weight | 260.14 g/mol |
| LogP | 3.92982 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.14124 |
| Heavy Atoms | 19 |
| Complexity | 625.66205 |
Chemical Identifiers
| CAS Number | 75908-57-5 |
|---|---|
| SMILES | CCCCCCC1=CC2=C(C=C1O)OC(=O)C=C2C |
Product Overview
6-Hexyl-4-methyl-7-hydroxycumarin (CAS 75908-57-5), with molecular formula C16H20O3 and molecular weight 260.14 g/mol. IUPAC: 6-hexyl-7-hydroxy-4-methylchromen-2-one.
Chemical Property Profile of 6-Hexyl-4-methyl-7-hydroxycumarin
Property Insights of 6-Hexyl-4-methyl-7-hydroxycumarin
The XLogP value of 3.92982 indicates that 6-Hexyl-4-methyl-7-hydroxycumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 6-Hexyl-4-methyl-7-hydroxycumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hexyl-4-methyl-7-hydroxycumarin has 1 hydrogen bond donor(s) and 3 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 6-Hexyl-4-methyl-7-hydroxycumarin?
The CAS number of 6-Hexyl-4-methyl-7-hydroxycumarin is 75908-57-5.
What is the molecular formula of 6-Hexyl-4-methyl-7-hydroxycumarin?
The molecular formula of 6-Hexyl-4-methyl-7-hydroxycumarin is C16H20O3.
What is the molecular weight of 6-Hexyl-4-methyl-7-hydroxycumarin?
The molecular weight of 6-Hexyl-4-methyl-7-hydroxycumarin is 260.14 g/mol.
Where can I buy 6-Hexyl-4-methyl-7-hydroxycumarin?
You can request a quote for 6-Hexyl-4-methyl-7-hydroxycumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hexyl-4-methyl-7-hydroxycumarin?
Yes, KEHONG BIO provides custom synthesis services for 6-Hexyl-4-methyl-7-hydroxycumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.