Suberenol
TL;DR: Suberenol (CAS 18529-47-0) is a chemical compound with molecular formula C15H16O4 and molecular weight 260.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-3-hydroxy-3-methylbut-1-enyl]-7-methoxychromen-2-one
Also Known As: Suberenol, trans-Suberenol, (E)-Suberenol, 6-[(E)-3-hydroxy-3-methylbut-1-enyl]-7-methoxychromen-2-one, ethyl 3-(N-4-fluorophenyl)aminobut-2-enoate
| Molecular Formula | C15H16O4 |
|---|---|
| Molecular Weight | 260.10 g/mol |
| LogP | 2.5857 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.10486 |
| Heavy Atoms | 19 |
| Complexity | 674.5856 |
Chemical Identifiers
| CAS Number | 18529-47-0 |
|---|---|
| SMILES | CC(C)(/C=C/C1=C(C=C2C(=C1)C=CC(=O)O2)OC)O |
Product Overview
Suberenol (CAS 18529-47-0), with molecular formula C15H16O4 and molecular weight 260.10 g/mol. IUPAC: 6-[(E)-3-hydroxy-3-methylbut-1-enyl]-7-methoxychromen-2-one.
Chemical Property Profile of Suberenol
Property Insights of Suberenol
The XLogP value of 2.5857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Suberenol. With a topological polar surface area (TPSA) of 59.67 Ų, Suberenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Suberenol has 1 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 Suberenol?
The CAS number of Suberenol is 18529-47-0.
What is the molecular formula of Suberenol?
The molecular formula of Suberenol is C15H16O4.
What is the molecular weight of Suberenol?
The molecular weight of Suberenol is 260.10 g/mol.
Where can I buy Suberenol?
You can request a quote for Suberenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Suberenol?
Yes, KEHONG BIO provides custom synthesis services for Suberenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.