TL;DR: (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid (CAS 155814-16-7) is a chemical compound with molecular formula C11H11ClO4 and molecular weight 242.03459 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoic acid
Also Known As: 3-(2-chloro-3,4-dimethoxyphenyl)acrylic acid, 2-Chloro-3,4-dimethoxycinnamic acid, DEXAMETHASONEHEMISUCCINATE, (E)-3-(2-chloro-3,4-dimethoxyphenyl)acrylic acid, 2-CHLORO-3,4-DIMETHOXYCINNAMICACID
| Molecular Formula | C11H11ClO4 |
| Molecular Weight | 242.03459 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.03459 Da |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
| SMILES | COC1=C(C(=C(C=C1)/C=C/C(=O)O)Cl)OC |
| InChIKey | JIPTVEJKXDVECY-GQCTYLIASA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid. With a topological polar surface area (TPSA) of 55.8 Ų, (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid is 155814-16-7.
The molecular formula of (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid is C11H11ClO4.
The molecular weight of (E)-3-(2-Chloro-3,4-dimethoxy-phenyl)-acrylic acid is 242.03459 g/mol.
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