TL;DR: (Z)-1-(3-methoxyphenyl)-2-nitroethene (CAS 152356-73-5) is a chemical compound with molecular formula C9H9NO3 and molecular weight 179.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-3-[(Z)-2-nitroethenyl]benzene
Also Known As: (Z)-1-(3-methoxyphenyl)-2-nitroethene, 1-methoxy-3-[(Z)-2-nitroethenyl]benzene, Benzene, 1-methoxy-3-(2-nitroethenyl)-, (Z)-
| Molecular Formula | C9H9NO3 |
| Molecular Weight | 179.05824 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.05824 Da |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
| SMILES | COC1=CC=CC(=C1)/C=C\[N+](=O)[O-] |
| InChIKey | IJBGIPFDIABTKB-WAYWQWQTSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-1-(3-methoxyphenyl)-2-nitroethene. With a topological polar surface area (TPSA) of 55.1 Ų, (Z)-1-(3-methoxyphenyl)-2-nitroethene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-1-(3-methoxyphenyl)-2-nitroethene 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 (Z)-1-(3-methoxyphenyl)-2-nitroethene is 152356-73-5.
The molecular formula of (Z)-1-(3-methoxyphenyl)-2-nitroethene is C9H9NO3.
The molecular weight of (Z)-1-(3-methoxyphenyl)-2-nitroethene is 179.05824 g/mol.
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