(1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium
TL;DR: (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium (CAS 142547-16-8) is a chemical compound with molecular formula C9H16NO2+ and molecular weight 170.1181 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R,6R)-6-ethoxycarbonylcyclohex-3-en-1-yl]azanium
Also Known As: 6-(Ethoxycarbonyl)cyclohex-3-en-1-aminium, (1R,6R)-6-(ETHOXYCARBONYL)CYCLOHEX-3-EN-1-AMINIUM
Technical Specifications
| Molecular Formula | C9H16NO2+ |
| Molecular Weight | 170.1181 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.1181 Da |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
| SMILES | CCOC(=O)[C@@H]1CC=CC[C@H]1[NH3+] |
| InChIKey | PTXUIEXYXGXMEU-HTQZYQBOSA-O |
Chemical Property Profile of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium
Property Insights of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium. With a topological polar surface area (TPSA) of 53.9 Ų, (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium has 1 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 (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium?
The CAS number of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium is 142547-16-8.
What is the molecular formula of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium?
The molecular formula of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium is C9H16NO2+.
What is the molecular weight of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium?
The molecular weight of (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium is 170.1181 g/mol.
Where can I buy (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium?
You can request a quote for (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium?
Yes, CoreyChem provides custom synthesis services for (1R,6R)-6-(Ethoxycarbonyl)cyclohex-3-EN-1-aminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.