TL;DR: Diethylamine, 2-chloro-2'-iodo-N-methyl- (CAS 73912-42-2) is a chemical compound with molecular formula C5H11ClIN and molecular weight 246.96246 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-(2-iodoethyl)-N-methylethanamine
Also Known As: 2-Chloro-2'-iodo-N-methyldiethylamine, DIETHYLAMINE, 2-CHLORO-2'-IODO-N-METHYL-, (2-chloroethyl)(2-iodoethyl)methylamine, 2-chloro-N-(2-iodoethyl)-N-methylethanamine, 2-Chloro-N-(2-iodoethyl)-N-methylethan-1-amine
| Molecular Formula | C5H11ClIN |
| Molecular Weight | 246.96246 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.96246 Da |
| Heavy Atoms | 8 |
| Complexity | 51.0 |
| SMILES | CN(CCCl)CCI |
| InChIKey | AJIDEBATCVMFKU-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylamine, 2-chloro-2'-iodo-N-methyl-. With a topological polar surface area (TPSA) of 3.2 Ų, Diethylamine, 2-chloro-2'-iodo-N-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylamine, 2-chloro-2'-iodo-N-methyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diethylamine, 2-chloro-2'-iodo-N-methyl- is 73912-42-2.
The molecular formula of Diethylamine, 2-chloro-2'-iodo-N-methyl- is C5H11ClIN.
The molecular weight of Diethylamine, 2-chloro-2'-iodo-N-methyl- is 246.96246 g/mol.
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