2,6,6-Trimethyl-2-cyclohexen-1-ol
TL;DR: 2,6,6-Trimethyl-2-cyclohexen-1-ol (CAS 54345-59-4) is a chemical compound with molecular formula C9H16O and molecular weight 140.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6,6-trimethylcyclohex-2-en-1-ol
Also Known As: 2,6,6-Trimethyl-2-cyclohexen-1-ol, 2,6,6-trimethylcyclohex-2-en-1-ol, 2-Cyclohexen-1-ol, 2,6,6-trimethyl-, 2-CYCLOHEXEN-1-OL,2,6,6-TRIMETHYL-, RefChem:247849
| Molecular Formula | C9H16O |
|---|---|
| Molecular Weight | 140.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.12012 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 54345-59-4 |
|---|---|
| SMILES | CC1=CCCC(C1O)(C)C |
| InChIKey | QOIDDSNHBKJZNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6,6-Trimethyl-2-cyclohexen-1-ol (CAS 54345-59-4), with molecular formula C9H16O and molecular weight 140.12 g/mol. IUPAC: 2,6,6-trimethylcyclohex-2-en-1-ol.
Chemical Property Profile of 2,6,6-Trimethyl-2-cyclohexen-1-ol
Property Insights of 2,6,6-Trimethyl-2-cyclohexen-1-ol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,6-Trimethyl-2-cyclohexen-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,6,6-Trimethyl-2-cyclohexen-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,6-Trimethyl-2-cyclohexen-1-ol 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 2,6,6-Trimethyl-2-cyclohexen-1-ol?
The CAS number of 2,6,6-Trimethyl-2-cyclohexen-1-ol is 54345-59-4.
What is the molecular formula of 2,6,6-Trimethyl-2-cyclohexen-1-ol?
The molecular formula of 2,6,6-Trimethyl-2-cyclohexen-1-ol is C9H16O.
What is the molecular weight of 2,6,6-Trimethyl-2-cyclohexen-1-ol?
The molecular weight of 2,6,6-Trimethyl-2-cyclohexen-1-ol is 140.12 g/mol.
Where can I buy 2,6,6-Trimethyl-2-cyclohexen-1-ol?
You can request a quote for 2,6,6-Trimethyl-2-cyclohexen-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6,6-Trimethyl-2-cyclohexen-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2,6,6-Trimethyl-2-cyclohexen-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.