6-Allyloxy-4-methylcoumarin
TL;DR: 6-Allyloxy-4-methylcoumarin (CAS 90207-15-1) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-6-prop-2-enoxychromen-2-one
Also Known As: 6-ALLYLOXY-4-METHYLCOUMARIN, ChemDiv2_000960, 6-(allyloxy)-4-methyl-2H-chromen-2-one, 4-methyl-6-prop-2-enoxychromen-2-one, 6-allyloxy-4-methyl-chromen-2-one
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.66622 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 581.2377 |
Chemical Identifiers
| CAS Number | 90207-15-1 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=C(C=C2)OCC=C |
Product Overview
6-Allyloxy-4-methylcoumarin (CAS 90207-15-1), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 4-methyl-6-prop-2-enoxychromen-2-one.
Chemical Property Profile of 6-Allyloxy-4-methylcoumarin
Property Insights of 6-Allyloxy-4-methylcoumarin
The XLogP value of 2.66622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Allyloxy-4-methylcoumarin. With a topological polar surface area (TPSA) of 39.44 Ų, 6-Allyloxy-4-methylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Allyloxy-4-methylcoumarin has 0 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-Allyloxy-4-methylcoumarin?
The CAS number of 6-Allyloxy-4-methylcoumarin is 90207-15-1.
What is the molecular formula of 6-Allyloxy-4-methylcoumarin?
The molecular formula of 6-Allyloxy-4-methylcoumarin is C13H12O3.
What is the molecular weight of 6-Allyloxy-4-methylcoumarin?
The molecular weight of 6-Allyloxy-4-methylcoumarin is 216.08 g/mol.
Where can I buy 6-Allyloxy-4-methylcoumarin?
You can request a quote for 6-Allyloxy-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-Allyloxy-4-methylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 6-Allyloxy-4-methylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.