TL;DR: 1-Octene, 1-nitro-, (1E)- (CAS 127143-69-5) is a chemical compound with molecular formula C8H15NO2 and molecular weight 157.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-nitrooct-1-ene
Also Known As: 1-nitrooct-1-ene, 1-Nitro-1-octene, (E)-1-nitrooct-1-ene, (E)-1-Nitro-1-octene, 1-Octene, 1-nitro-, (1E)-
| Molecular Formula | C8H15NO2 |
| Molecular Weight | 157.11028 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 157.11028 Da |
| Heavy Atoms | 11 |
| Complexity | 127.0 |
| SMILES | CCCCCC/C=C/[N+](=O)[O-] |
| InChIKey | PGQZCAQEOAEPDW-BQYQJAHWSA-N |
The XLogP value of 3.5 indicates that 1-Octene, 1-nitro-, (1E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Octene, 1-nitro-, (1E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Octene, 1-nitro-, (1E)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Octene, 1-nitro-, (1E)- is 127143-69-5.
The molecular formula of 1-Octene, 1-nitro-, (1E)- is C8H15NO2.
The molecular weight of 1-Octene, 1-nitro-, (1E)- is 157.11028 g/mol.
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