TL;DR: 2-Octyl Cyanoacrylate (CAS 133978-15-1) is a chemical compound with molecular formula C12H19NO2 and molecular weight 209.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
octan-2-yl 2-cyanoprop-2-enoate
Also Known As: 2-OCTYL CYANOACRYLATE, Dermabond, Liquid Bandage, Octan-2-yl 2-cyanoacrylate, indermil
| Molecular Formula | C12H19NO2 |
| Molecular Weight | 209.14159 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 209.14159 Da |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
| SMILES | CCCCCCC(C)OC(=O)C(=C)C#N |
| InChIKey | CQVWXNBVRLKXPE-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 2-Octyl Cyanoacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.1 Ų, 2-Octyl Cyanoacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Octyl Cyanoacrylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Octyl Cyanoacrylate is 133978-15-1.
The molecular formula of 2-Octyl Cyanoacrylate is C12H19NO2.
The molecular weight of 2-Octyl Cyanoacrylate is 209.14159 g/mol.
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