2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate
TL;DR: 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate (CAS 15593-88-1) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylcyclohex-3-en-1-yl)prop-1-enyl acetate
Also Known As: 1,8-P-Menthadien-9-yl acetate, 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate, 2-(4-methylcyclohex-3-en-1-yl)prop-1-enyl acetate, 2-(4-methylcyclohex-3-en-1-yl)prop-1-en-1-yl acetate, 239-672-7
Technical Specifications
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.13068 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.13068 Da |
| Heavy Atoms | 14 |
| Complexity | 274.0 |
| SMILES | CC1=CCC(CC1)C(=COC(=O)C)C |
| InChIKey | CKITWLJZALNJDV-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate
Property Insights of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate?
The CAS number of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate is 15593-88-1.
What is the molecular formula of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate?
The molecular formula of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate is C12H18O2.
What is the molecular weight of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate?
The molecular weight of 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate is 194.13068 g/mol.
Where can I buy 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate?
You can request a quote for 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate?
Yes, CoreyChem provides custom synthesis services for 2-(4-Methyl-3-cyclohexen-1-yl)propenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.