8-Allyl-7-hydroxy-4-methyl-chromen-2-one
TL;DR: 8-Allyl-7-hydroxy-4-methyl-chromen-2-one (CAS 1616-54-2) 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.
7-hydroxy-4-methyl-8-prop-2-enylchromen-2-one
Also Known As: Maybridge3_000425, 4-Methyl-7-hydroxy-8-allylcoumarin, 8-Allyl-7-hydroxy-4-methylcoumarin, 8-allyl-7-hydroxy-4-methyl-chromen-2-one, 7-hydroxy-8-allyl-4-methylcoumarin
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.53552 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 608.3392 |
Chemical Identifiers
| CAS Number | 1616-54-2 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2CC=C)O |
Product Overview
8-Allyl-7-hydroxy-4-methyl-chromen-2-one (CAS 1616-54-2), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 7-hydroxy-4-methyl-8-prop-2-enylchromen-2-one.
Chemical Property Profile of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one
Property Insights of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one
The XLogP value of 2.53552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Allyl-7-hydroxy-4-methyl-chromen-2-one. With a topological polar surface area (TPSA) of 50.44 Ų, 8-Allyl-7-hydroxy-4-methyl-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Allyl-7-hydroxy-4-methyl-chromen-2-one 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 8-Allyl-7-hydroxy-4-methyl-chromen-2-one?
The CAS number of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one is 1616-54-2.
What is the molecular formula of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one?
The molecular formula of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one is C13H12O3.
What is the molecular weight of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one?
The molecular weight of 8-Allyl-7-hydroxy-4-methyl-chromen-2-one is 216.08 g/mol.
Where can I buy 8-Allyl-7-hydroxy-4-methyl-chromen-2-one?
You can request a quote for 8-Allyl-7-hydroxy-4-methyl-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 8-Allyl-7-hydroxy-4-methyl-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Allyl-7-hydroxy-4-methyl-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.