![[2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid structure](/static/products/9807/98072-14-1.webp)
[2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid
TL;DR: [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid (CAS 98072-14-1) is a chemical compound with molecular formula C10H19O3P and molecular weight 218.10718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylcyclohex-3-en-1-yl)propylphosphonic acid
Also Known As: [2- propyl]phosphonicacid|[2-(4-methylcyclohex-3-en-1-yl)propyl]phosphonic acid|KST-1A0165|(2-(4-Methylcyclohex-3-en-1-yl)propyl)phosphonic acid|2-(4-methylcyclohex-3-en-1-yl)propylphosphonic acid|[2-(4-Methyl-3-cyclohexen-1-yl)propyl]phosphonic acid|EINECS 308-463-3|QBOXAKWKMIZAPC-UHFFFAOYSA-N|NS00065836
Technical Specifications
| Molecular Formula | C10H19O3P |
| Molecular Weight | 218.10718 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.10718 Da |
| Heavy Atoms | 14 |
| Complexity | 267.0 |
| SMILES | CC1=CCC(CC1)C(C)CP(=O)(O)O |
| InChIKey | QBOXAKWKMIZAPC-UHFFFAOYSA-N |
Chemical Property Profile of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid
Property Insights of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid. With a topological polar surface area (TPSA) of 57.5 Ų, [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid has 2 hydrogen bond donor(s) and 3 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-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid?
The CAS number of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid is 98072-14-1.
What is the molecular formula of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid?
The molecular formula of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid is C10H19O3P.
What is the molecular weight of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid?
The molecular weight of [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid is 218.10718 g/mol.
Where can I buy [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid?
You can request a quote for [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid?
Yes, CoreyChem provides custom synthesis services for [2-(4-Methylcyclohex-3-en-1-yl)propyl]phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.