Psoralenol
TL;DR: Psoralenol (CAS 70522-30-4) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-3-(3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)chromen-4-one
Also Known As: Psoralenol, 7-hydroxy-3-(3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)chromen-4-one, 7-hydroxy-3-(2-(2-hydroxypropan-2-yl)-23-dihydrobenzofuran-5-yl)-4H-chromen-4-one, 7-hydroxy-3-(3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-4H-chromen-4-one, 2 ,3 -Dihydro-3 ,7-dihydroxy-2 ,2 -dimethyl-3,6 -bi(4H-1-benzopyran)-4-one
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 3.24 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 1031.9263 |
Chemical Identifiers
| CAS Number | 70522-30-4 |
|---|---|
| SMILES | CC1(C(CC2=C(O1)C=CC(=C2)C3=COC4=C(C3=O)C=CC(=C4)O)O)C |
Product Overview
Psoralenol (CAS 70522-30-4), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: 7-hydroxy-3-(3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)chromen-4-one.
Chemical Property Profile of Psoralenol
Property Insights of Psoralenol
The XLogP value of 3.24 indicates that Psoralenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Psoralenol. Following Lipinski's Rule of Five, Psoralenol 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
Frequently Asked Questions
What is the CAS number of Psoralenol?
The CAS number of Psoralenol is 70522-30-4.
What is the molecular formula of Psoralenol?
The molecular formula of Psoralenol is C20H18O5.
What is the molecular weight of Psoralenol?
The molecular weight of Psoralenol is 338.12 g/mol.
Where can I buy Psoralenol?
You can request a quote for Psoralenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Psoralenol?
Yes, KEHONG BIO provides custom synthesis services for Psoralenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.