TL;DR: Diphenethylamine, N-(2-chloroethyl)-, hydrochloride (CAS 66842-81-7) is a chemical compound with molecular formula C18H23Cl2N and molecular weight 323.12076 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroethyl-bis(2-phenylethyl)azanium chloride
Also Known As: N-(2-Chloroethyl)diphenethylamine hydrochloride, 2-chloroethyl(diphenethyl)azanium chloride, DIPHENETHYLAMINE, N-(2-CHLOROETHYL)-, HYDROCHLORIDE, Benzeneethanamine, N-(2-chloroethyl)-N-(2-phenylethyl)-, hydrochloride
| Molecular Formula | C18H23Cl2N |
| Molecular Weight | 323.12076 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 323.12076 Da |
| Heavy Atoms | 21 |
| Complexity | 210.0 |
| SMILES | C1=CC=C(C=C1)CC[NH+](CCC2=CC=CC=C2)CCCl.[Cl-] |
| InChIKey | BFGBJKWDQRHQFO-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that Diphenethylamine, N-(2-chloroethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, Diphenethylamine, N-(2-chloroethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenethylamine, N-(2-chloroethyl)-, hydrochloride has 1 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 Diphenethylamine, N-(2-chloroethyl)-, hydrochloride is 66842-81-7.
The molecular formula of Diphenethylamine, N-(2-chloroethyl)-, hydrochloride is C18H23Cl2N.
The molecular weight of Diphenethylamine, N-(2-chloroethyl)-, hydrochloride is 323.12076 g/mol.
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