1,3,3,5,5-Pentamethylcyclohexanol
TL;DR: 1,3,3,5,5-Pentamethylcyclohexanol (CAS 38490-33-4) is a chemical compound with molecular formula C11H22O and molecular weight 170.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3,5,5-pentamethylcyclohexan-1-ol
Also Known As: 1,3,3,5,5-Pentamethylcyclohexanol, 1,3,3,5,5-pentamethylcyclohexan-1-ol, 1,3,3,5,5-pentamethylcyclohexanoi, Cyclohexanol,1,3,3,5,5-pentamethyl-, 1-hydroxy-1,3,3,5,5-pentamethylcyclohexane
| Molecular Formula | C11H22O |
|---|---|
| Molecular Weight | 170.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.16707 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 38490-33-4 |
|---|---|
| SMILES | CC1(CC(CC(C1)(C)O)(C)C)C |
| InChIKey | BMRINMQQUFUCHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,3,5,5-Pentamethylcyclohexanol (CAS 38490-33-4), with molecular formula C11H22O and molecular weight 170.17 g/mol. IUPAC: 1,3,3,5,5-pentamethylcyclohexan-1-ol.
Chemical Property Profile of 1,3,3,5,5-Pentamethylcyclohexanol
Property Insights of 1,3,3,5,5-Pentamethylcyclohexanol
The XLogP value of 3.2 indicates that 1,3,3,5,5-Pentamethylcyclohexanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1,3,3,5,5-Pentamethylcyclohexanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,3,5,5-Pentamethylcyclohexanol 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 1,3,3,5,5-Pentamethylcyclohexanol?
The CAS number of 1,3,3,5,5-Pentamethylcyclohexanol is 38490-33-4.
What is the molecular formula of 1,3,3,5,5-Pentamethylcyclohexanol?
The molecular formula of 1,3,3,5,5-Pentamethylcyclohexanol is C11H22O.
What is the molecular weight of 1,3,3,5,5-Pentamethylcyclohexanol?
The molecular weight of 1,3,3,5,5-Pentamethylcyclohexanol is 170.17 g/mol.
Where can I buy 1,3,3,5,5-Pentamethylcyclohexanol?
You can request a quote for 1,3,3,5,5-Pentamethylcyclohexanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,3,5,5-Pentamethylcyclohexanol?
Yes, KEHONG BIO provides custom synthesis services for 1,3,3,5,5-Pentamethylcyclohexanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.