4-Hydroxygrenoblone
TL;DR: 4-Hydroxygrenoblone (CAS 113888-20-3) is a chemical compound with molecular formula C26H30O5 and molecular weight 422.20932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-hydroxy-7-[3-(4-hydroxyphenyl)propanoyl]-2,2,5-trimethyl-5-(3-methylbut-2-enyl)chromen-6-one
Also Known As: 4-Hydroxygrenoblone, J3.248.081K, 8-hydroxy-7-[3-(4-hydroxyphenyl)propanoyl]-2,2,5-trimethyl-5-(3-methylbut-2-enyl)chromen-6-one, 8-Hydroxy-5-prenyl-7-[3-(4-hydroxyphenyl)propanoyl]-2,2,5-trimethyl-2H-1-benzopyran-6(5H)-one, 8-Hydroxy-7-[3-(4-hydroxyphenyl)propanoyl]-2,2,5-trimethyl-5-(3-methylbut-2-en-1-yl)-2H-1-benzopyran-6(5H)-one
Technical Specifications
| Molecular Formula | C26H30O5 |
| Molecular Weight | 422.20932 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.20932 Da |
| Heavy Atoms | 31 |
| Complexity | 873.0 |
| SMILES | CC(=CCC1(C2=C(C(=C(C1=O)C(=O)CCC3=CC=C(C=C3)O)O)OC(C=C2)(C)C)C)C |
| InChIKey | OMAKHIMGWFTYNH-UHFFFAOYSA-N |
Chemical Property Profile of 4-Hydroxygrenoblone
Property Insights of 4-Hydroxygrenoblone
The XLogP value of 4.9 indicates that 4-Hydroxygrenoblone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxygrenoblone. Following Lipinski's Rule of Five, 4-Hydroxygrenoblone has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Hydroxygrenoblone?
The CAS number of 4-Hydroxygrenoblone is 113888-20-3.
What is the molecular formula of 4-Hydroxygrenoblone?
The molecular formula of 4-Hydroxygrenoblone is C26H30O5.
What is the molecular weight of 4-Hydroxygrenoblone?
The molecular weight of 4-Hydroxygrenoblone is 422.20932 g/mol.
Where can I buy 4-Hydroxygrenoblone?
You can request a quote for 4-Hydroxygrenoblone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Hydroxygrenoblone?
Yes, CoreyChem provides custom synthesis services for 4-Hydroxygrenoblone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.