TL;DR: 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate (CAS 108114-64-3) is a chemical compound with molecular formula C13H7Cl4NO2 and molecular weight 348.9231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,5-dichlorophenyl) N-(3,4-dichlorophenyl)carbamate
Also Known As: 3,5-dichlorophenyl 3,4-dichlorophenylcarbamate, (3,5-dichlorophenyl) N-(3,4-dichlorophenyl)carbamate, 3,5-dichlorophenyl n-(3,4-dichlorophenyl)carbamate
| Molecular Formula | C13H7Cl4NO2 |
| Molecular Weight | 348.9231 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.9231 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | C1=CC(=C(C=C1NC(=O)OC2=CC(=CC(=C2)Cl)Cl)Cl)Cl |
| InChIKey | OEROCOPYDDIGGC-UHFFFAOYSA-N |
The XLogP value of 6.4 indicates that 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate is 108114-64-3.
The molecular formula of 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate is C13H7Cl4NO2.
The molecular weight of 3,5-Dichlorophenyl 3,4-dichlorophenylcarbamate is 348.9231 g/mol.
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