6,7-Diallyloxy-4-methylcoumarin
TL;DR: 6,7-Diallyloxy-4-methylcoumarin (CAS 116703-26-5) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-6,7-bis(prop-2-enoxy)chromen-2-one
Also Known As: 6,7-DIALLYLOXY-4-METHYLCOUMARIN, 6,7-bis(allyloxy)-4-methyl-2H-chromen-2-one, 4-methyl-6,7-bis(prop-2-enoxy)chromen-2-one, 4-methyl-6,7-diprop-2-enyloxychromen-2-one, 2H-1-Benzopyran-2-one, 4-methyl-6,7-bis(2-propen-1-yloxy)-
| Molecular Formula | C16H16O4 |
|---|---|
| Molecular Weight | 272.10 g/mol |
| LogP | 3.23102 |
| Topological Polar Surface Area | 48.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.10486 |
| Heavy Atoms | 20 |
| Complexity | 697.4245 |
Chemical Identifiers
| CAS Number | 116703-26-5 |
|---|---|
| SMILES | CC1=CC(=O)OC2=CC(=C(C=C12)OCC=C)OCC=C |
Product Overview
6,7-Diallyloxy-4-methylcoumarin (CAS 116703-26-5), with molecular formula C16H16O4 and molecular weight 272.10 g/mol. IUPAC: 4-methyl-6,7-bis(prop-2-enoxy)chromen-2-one.
Chemical Property Profile of 6,7-Diallyloxy-4-methylcoumarin
Property Insights of 6,7-Diallyloxy-4-methylcoumarin
The XLogP value of 3.23102 indicates that 6,7-Diallyloxy-4-methylcoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.67 Ų, 6,7-Diallyloxy-4-methylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Diallyloxy-4-methylcoumarin 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 6,7-Diallyloxy-4-methylcoumarin?
The CAS number of 6,7-Diallyloxy-4-methylcoumarin is 116703-26-5.
What is the molecular formula of 6,7-Diallyloxy-4-methylcoumarin?
The molecular formula of 6,7-Diallyloxy-4-methylcoumarin is C16H16O4.
What is the molecular weight of 6,7-Diallyloxy-4-methylcoumarin?
The molecular weight of 6,7-Diallyloxy-4-methylcoumarin is 272.10 g/mol.
Where can I buy 6,7-Diallyloxy-4-methylcoumarin?
You can request a quote for 6,7-Diallyloxy-4-methylcoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Diallyloxy-4-methylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Diallyloxy-4-methylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.