6-Hydroxydihydrotheaspirane
TL;DR: 6-Hydroxydihydrotheaspirane (CAS 53398-90-6) is a chemical compound with molecular formula C13H24O2 and molecular weight 212.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
Also Known As: 6-Hydroxydihydrotheaspirane, FEMA No. 3549, 2,6,10,10-Tetramethyl-1-oxaspiro[4.5]decan-6-ol, FEMA 3549, 2,6,10,10-Tetramethyl-1-oxaspiro(4.5)decan-6-ol
| Molecular Formula | C13H24O2 |
|---|---|
| Molecular Weight | 212.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.17763 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
| Density | 1.006-1.010 |
| Solubility | Soluble in fats; insoluble in water |
| Refractive Index | 1.481-1.487 |
Chemical Identifiers
| CAS Number | 53398-90-6 |
|---|---|
| SMILES | CC1CCC2(O1)C(CCCC2(C)O)(C)C |
| InChIKey | LJOISVFAMDWVFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Hydroxydihydrotheaspirane (CAS 53398-90-6), with molecular formula C13H24O2 and molecular weight 212.18 g/mol. IUPAC: 2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol.
Chemical Property Profile of 6-Hydroxydihydrotheaspirane
Property Insights of 6-Hydroxydihydrotheaspirane
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxydihydrotheaspirane. With a topological polar surface area (TPSA) of 29.5 Ų, 6-Hydroxydihydrotheaspirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxydihydrotheaspirane has 1 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 6-Hydroxydihydrotheaspirane?
The CAS number of 6-Hydroxydihydrotheaspirane is 53398-90-6.
What is the molecular formula of 6-Hydroxydihydrotheaspirane?
The molecular formula of 6-Hydroxydihydrotheaspirane is C13H24O2.
What is the molecular weight of 6-Hydroxydihydrotheaspirane?
The molecular weight of 6-Hydroxydihydrotheaspirane is 212.18 g/mol.
Where can I buy 6-Hydroxydihydrotheaspirane?
You can request a quote for 6-Hydroxydihydrotheaspirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxydihydrotheaspirane?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxydihydrotheaspirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.