1-Butyl-3-methylcyclohex-2-en-1-ol
TL;DR: 1-Butyl-3-methylcyclohex-2-en-1-ol (CAS 122364-47-0) is a chemical compound with molecular formula C11H20O and molecular weight 168.15141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-3-methylcyclohex-2-en-1-ol
Also Known As: 1-butyl-3-methylcyclohex-2-en-1-ol, 1-Butyl-3-methyl-2-cyclohexen-1-ol, 2-Cyclohexen-1-ol, 1-butyl-3-methyl-, 1-Butyl-3-methyl-2-cyclohexen-1-ol #
Technical Specifications
| Molecular Formula | C11H20O |
| Molecular Weight | 168.15141 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.15141 Da |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
| SMILES | CCCCC1(CCCC(=C1)C)O |
| InChIKey | DXCCDGWGQJSGTI-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butyl-3-methylcyclohex-2-en-1-ol
Property Insights of 1-Butyl-3-methylcyclohex-2-en-1-ol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-3-methylcyclohex-2-en-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Butyl-3-methylcyclohex-2-en-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-3-methylcyclohex-2-en-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
What is the CAS number of 1-Butyl-3-methylcyclohex-2-en-1-ol?
The CAS number of 1-Butyl-3-methylcyclohex-2-en-1-ol is 122364-47-0.
What is the molecular formula of 1-Butyl-3-methylcyclohex-2-en-1-ol?
The molecular formula of 1-Butyl-3-methylcyclohex-2-en-1-ol is C11H20O.
What is the molecular weight of 1-Butyl-3-methylcyclohex-2-en-1-ol?
The molecular weight of 1-Butyl-3-methylcyclohex-2-en-1-ol is 168.15141 g/mol.
Where can I buy 1-Butyl-3-methylcyclohex-2-en-1-ol?
You can request a quote for 1-Butyl-3-methylcyclohex-2-en-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butyl-3-methylcyclohex-2-en-1-ol?
Yes, CoreyChem provides custom synthesis services for 1-Butyl-3-methylcyclohex-2-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.