7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one
TL;DR: 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one (CAS 82747-40-8) is a chemical compound with molecular formula C11H7F3O3 and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-8-methyl-4-(trifluoromethyl)chromen-2-one
Also Known As: 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one, 7-hydroxy-8-methyl-4-(trifluoromethyl)chromen-2-one, 4-trifluoromethyl-7-hydroxy-8-methylcoumarin, 7-hydroxy-8-methyl-4-trifluoromethyl coumarin, 2H-1-Benzopyran-2-one, 7-hydroxy-8-methyl-4-(trifluoromethyl)-
| Molecular Formula | C11H7F3O3 |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 2.82582 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.03473 |
| Heavy Atoms | 17 |
| Complexity | 640.6773 |
Chemical Identifiers
| CAS Number | 82747-40-8 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C=C2C(F)(F)F)O |
Product Overview
7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one (CAS 82747-40-8), with molecular formula C11H7F3O3 and molecular weight 244.03 g/mol. IUPAC: 7-hydroxy-8-methyl-4-(trifluoromethyl)chromen-2-one.
Chemical Property Profile of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one
Property Insights of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one
The XLogP value of 2.82582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one. With a topological polar surface area (TPSA) of 50.44 Ų, 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-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 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one?
The CAS number of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one is 82747-40-8.
What is the molecular formula of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one?
The molecular formula of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one is C11H7F3O3.
What is the molecular weight of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one?
The molecular weight of 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one is 244.03 g/mol.
Where can I buy 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one?
You can request a quote for 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-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 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-hydroxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.