Sobrerol
TL;DR: Sobrerol (CAS 498-71-5) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-ol
Also Known As: Sobrerol, Sobrepin, Soberol, Pinol hydrate, Lysmucol
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 498-71-5 |
|---|---|
| SMILES | CC1=CCC(CC1O)C(C)(C)O |
| InChIKey | OMDMTHRBGUBUCO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sobrerol (CAS 498-71-5), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-ol.
Chemical Property Profile of Sobrerol
Property Insights of Sobrerol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sobrerol. With a topological polar surface area (TPSA) of 40.5 Ų, Sobrerol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sobrerol has 2 hydrogen bond donor(s) and 2 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 Sobrerol?
The CAS number of Sobrerol is 498-71-5.
What is the molecular formula of Sobrerol?
The molecular formula of Sobrerol is C10H18O2.
What is the molecular weight of Sobrerol?
The molecular weight of Sobrerol is 170.13 g/mol.
Where can I buy Sobrerol?
You can request a quote for Sobrerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sobrerol?
Yes, KEHONG BIO provides custom synthesis services for Sobrerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.