TL;DR: (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride (CAS 1089305-25-8) is a chemical compound with molecular formula C11H8ClNO2 and molecular weight 221.02435 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride
Also Known As: (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride, (Z)-2-cyano-3-(4-methoxyphenyl)acryloyl chloride, (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride
| Molecular Formula | C11H8ClNO2 |
| Molecular Weight | 221.02435 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.02435 Da |
| Heavy Atoms | 15 |
| Complexity | 308.0 |
| SMILES | COC1=CC=C(C=C1)/C=C(/C#N)\C(=O)Cl |
| InChIKey | UZSAZHVTRXUECQ-TWGQIWQCSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride. With a topological polar surface area (TPSA) of 50.1 Ų, (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride 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 (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride is 1089305-25-8.
The molecular formula of (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride is C11H8ClNO2.
The molecular weight of (2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl chloride is 221.02435 g/mol.
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