5-(Hexyloxy)psoralen
TL;DR: 5-(Hexyloxy)psoralen (CAS 102416-40-0) is a chemical compound with molecular formula C17H18O4 and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexoxyfuro[3,2-g]chromen-7-one
Also Known As: 5-(Hexyloxy)psoralen, 4-hexoxyfuro[3,2-g]chromen-7-one, 4-(Hexyloxy)-7H-furo[3,2-g][1]benzopyran-7-one, 7H-Furo(3,2-g)(1)benzopyran-7-one,4-(hexyloxy), 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(hexyloxy)-
| Molecular Formula | C17H18O4 |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 48.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.1205 |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 102416-40-0 |
|---|---|
| SMILES | CCCCCCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3 |
| InChIKey | GKHMMQBGYNWAFJ-UHFFFAOYSA-N |
Product Overview
5-(Hexyloxy)psoralen (CAS 102416-40-0), with molecular formula C17H18O4 and molecular weight 286.12 g/mol. IUPAC: 4-hexoxyfuro[3,2-g]chromen-7-one.
Chemical Property Profile of 5-(Hexyloxy)psoralen
Property Insights of 5-(Hexyloxy)psoralen
The XLogP value of 4.6 indicates that 5-(Hexyloxy)psoralen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.7 Ų, 5-(Hexyloxy)psoralen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Hexyloxy)psoralen has 0 hydrogen bond donor(s) and 4 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-(Hexyloxy)psoralen?
The CAS number of 5-(Hexyloxy)psoralen is 102416-40-0.
What is the molecular formula of 5-(Hexyloxy)psoralen?
The molecular formula of 5-(Hexyloxy)psoralen is C17H18O4.
What is the molecular weight of 5-(Hexyloxy)psoralen?
The molecular weight of 5-(Hexyloxy)psoralen is 286.12 g/mol.
Where can I buy 5-(Hexyloxy)psoralen?
You can request a quote for 5-(Hexyloxy)psoralen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Hexyloxy)psoralen?
Yes, KEHONG BIO provides custom synthesis services for 5-(Hexyloxy)psoralen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.