2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-
TL;DR: 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- (CAS 22065-07-2) is a chemical compound with molecular formula C9H6O5 and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trihydroxychromen-2-one
Also Known As: 3,5,7-trihydroxychromen-2-one, 3,5,7-Trihydroxycoumarin, Coumarin, 3,5,7-trihydroxy-, 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-, 3,5,7-Trihydroxy-2H-chromen-2-one
| Molecular Formula | C9H6O5 |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 0.9098 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.02153 |
| Heavy Atoms | 14 |
| Complexity | 554.8663 |
Chemical Identifiers
| CAS Number | 22065-07-2 |
|---|---|
| SMILES | C1=C(C=C2C(=C1O)C=C(C(=O)O2)O)O |
Product Overview
2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- (CAS 22065-07-2), with molecular formula C9H6O5 and molecular weight 194.02 g/mol. IUPAC: 3,5,7-trihydroxychromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-
Property Insights of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-
The XLogP value of 0.9098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- has 3 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 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-?
The CAS number of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- is 22065-07-2.
What is the molecular formula of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-?
The molecular formula of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- is C9H6O5.
What is the molecular weight of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-?
The molecular weight of 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- is 194.02 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-?
You can request a quote for 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.