Epoxyaurapten
TL;DR: Epoxyaurapten (CAS 21499-17-2) is a chemical compound with molecular formula C19H22O4 and molecular weight 314.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enoxy]chromen-2-one
Also Known As: Epoxyaurapten, 6',7'-Epoxyaurapten, (+/-)-Epoxyaurapten, Epoxyaurapten[C19H22O3], 6',7'-Epoxy-7-geranyloxycoumarin
| Molecular Formula | C19H22O4 |
|---|---|
| Molecular Weight | 314.15 g/mol |
| LogP | 4.0757 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1518 |
| Heavy Atoms | 23 |
| Complexity | 785.30133 |
Chemical Identifiers
| CAS Number | 21499-17-2 |
|---|---|
| SMILES | C/C(=C\COC1=CC2=C(C=C1)C=CC(=O)O2)/CCC3C(O3)(C)C |
Product Overview
Epoxyaurapten (CAS 21499-17-2), with molecular formula C19H22O4 and molecular weight 314.15 g/mol. IUPAC: 7-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enoxy]chromen-2-one.
Chemical Property Profile of Epoxyaurapten
Property Insights of Epoxyaurapten
The XLogP value of 4.0757 indicates that Epoxyaurapten is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, Epoxyaurapten exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Epoxyaurapten 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 Epoxyaurapten?
The CAS number of Epoxyaurapten is 21499-17-2.
What is the molecular formula of Epoxyaurapten?
The molecular formula of Epoxyaurapten is C19H22O4.
What is the molecular weight of Epoxyaurapten?
The molecular weight of Epoxyaurapten is 314.15 g/mol.
Where can I buy Epoxyaurapten?
You can request a quote for Epoxyaurapten directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epoxyaurapten?
Yes, KEHONG BIO provides custom synthesis services for Epoxyaurapten and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.