5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One
TL;DR: 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One (CAS 37719-98-5) is a chemical compound with molecular formula C16H16O5 and molecular weight 288.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethoxy-8-(3-methylbut-2-enoyl)chromen-2-one
Also Known As: Angelicone, Glabralactone, 5,7-dimethoxy-8-(3-methylbut-2-enoyl)chromen-2-one, 5,7-dimethoxy-8-(3-methylbut-2-enoyl)-2H-chromen-2-one, 5,7-Dimethoxy-8-(3-methyl-1-oxo-2-butenyl)coumarin
| Molecular Formula | C16H16O5 |
|---|---|
| Molecular Weight | 288.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.09976 |
| Heavy Atoms | 21 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 37719-98-5 |
|---|---|
| SMILES | CC(=CC(=O)C1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)C |
| InChIKey | JEDBBFHVVHKMKS-UHFFFAOYSA-N |
Product Overview
5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One (CAS 37719-98-5), with molecular formula C16H16O5 and molecular weight 288.10 g/mol. IUPAC: 5,7-dimethoxy-8-(3-methylbut-2-enoyl)chromen-2-one.
Chemical Property Profile of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One
Property Insights of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One
The XLogP value of 3.0 indicates that 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One. Following Lipinski's Rule of Five, 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One has 0 hydrogen bond donor(s) and 5 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 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One?
The CAS number of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One is 37719-98-5.
What is the molecular formula of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One?
The molecular formula of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One is C16H16O5.
What is the molecular weight of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One?
The molecular weight of 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One is 288.10 g/mol.
Where can I buy 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One?
You can request a quote for 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)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 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dimethoxy-8-(3-Methylbut-2-Enoyl)Chromen-2-One and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.