TL;DR: Butyric acid, 2,3,4,6-tetrachlorophenyl ester (CAS 7476-82-6) is a chemical compound with molecular formula C10H8Cl4O2 and molecular weight 299.92783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3,4,6-tetrachlorophenyl) butanoate
Also Known As: 2,3,4,6-Tetrachlorophenyl butyrate, (2,3,4,6-tetrachlorophenyl) butanoate, BUTYRIC ACID, 2,3,4,6-TETRACHLOROPHENYL ESTER, 2,3,4,6-TETRACHLOROPHENYL BUTANOATE, Butanoic acid, 2,3,4,6-tetrachlorophenyl ester
| Molecular Formula | C10H8Cl4O2 |
| Molecular Weight | 299.92783 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.9249 Da |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
| SMILES | CCCC(=O)OC1=C(C(=C(C=C1Cl)Cl)Cl)Cl |
| InChIKey | DZBDHMZJGXLTDK-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that Butyric acid, 2,3,4,6-tetrachlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyric acid, 2,3,4,6-tetrachlorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 2,3,4,6-tetrachlorophenyl ester 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 Butyric acid, 2,3,4,6-tetrachlorophenyl ester is 7476-82-6.
The molecular formula of Butyric acid, 2,3,4,6-tetrachlorophenyl ester is C10H8Cl4O2.
The molecular weight of Butyric acid, 2,3,4,6-tetrachlorophenyl ester is 299.92783 g/mol.
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