3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL
TL;DR: 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL (CAS 70172-00-8) is a chemical compound with molecular formula C14H24O and molecular weight 208.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol
Also Known As: 3-Buten-2-ol, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol, 3-METHYL-4-(2,6,6-TRIMETHYLCYCLOHEX-2-EN-1-YL)BUT-3-EN-2-OL
| Molecular Formula | C14H24O |
|---|---|
| Molecular Weight | 208.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.18271 |
| Heavy Atoms | 15 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 70172-00-8 |
|---|---|
| SMILES | CC1=CCCC(C1C=C(C)C(C)O)(C)C |
| InChIKey | LDDHQAGSKKNKSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL (CAS 70172-00-8), with molecular formula C14H24O and molecular weight 208.18 g/mol. IUPAC: 3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol.
Chemical Property Profile of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL
Property Insights of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL
The XLogP value of 3.6 indicates that 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-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 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL?
The CAS number of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL is 70172-00-8.
What is the molecular formula of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL?
The molecular formula of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL is C14H24O.
What is the molecular weight of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL?
The molecular weight of 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL is 208.18 g/mol.
Where can I buy 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL?
You can request a quote for 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4-(2,6,6-trimethylcyclohex-2-EN-1-YL)but-3-EN-2-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.