Tetrahydrolinalool
TL;DR: Tetrahydrolinalool (CAS 78-69-3) is a chemical compound with molecular formula C10H22O and molecular weight 158.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethyloctan-3-ol
Also Known As: 3,7-Dimethyloctan-3-ol, TETRAHYDROLINALOOL, 3,7-Dimethyl-3-octanol, Linalool tetrahydride, 3-Octanol, 3,7-dimethyl-
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 99.0 |
| Density | 0.823-0.829 |
| Solubility | soluble in alcohol, most fixed oils; insoluble in water |
| Vapor Pressure | 0.01 [mmHg] |
| Refractive Index | 1.431-1.435 |
Chemical Identifiers
| CAS Number | 78-69-3 |
|---|---|
| SMILES | CCC(C)(CCCC(C)C)O |
| InChIKey | DLHQZZUEERVIGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrahydrolinalool (CAS 78-69-3), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 3,7-dimethyloctan-3-ol.
Chemical Property Profile of Tetrahydrolinalool
Property Insights of Tetrahydrolinalool
The XLogP value of 3.3 indicates that Tetrahydrolinalool is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Tetrahydrolinalool exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydrolinalool has 1 hydrogen bond donor(s) and 1 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 Tetrahydrolinalool?
The CAS number of Tetrahydrolinalool is 78-69-3.
What is the molecular formula of Tetrahydrolinalool?
The molecular formula of Tetrahydrolinalool is C10H22O.
What is the molecular weight of Tetrahydrolinalool?
The molecular weight of Tetrahydrolinalool is 158.17 g/mol.
Where can I buy Tetrahydrolinalool?
You can request a quote for Tetrahydrolinalool directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydrolinalool?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydrolinalool and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.