TL;DR: 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride (CAS 63765-81-1) is a chemical compound with molecular formula C21H30ClNO and molecular weight 347.2016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-hydroxy-2-methyl-3,3-diphenylhexyl)-dimethylazanium chloride
Also Known As: 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride, 3-HEXANOL, 6-(N,N-DIMETHYLAMINO)-4,4-DIPHENYL-5-METHYL-, HYDROCHLORIDE, (4-hydroxy-2-methyl-3,3-diphenylhexyl)-dimethylazanium chloride, Benzeneethanol, .beta.-[2-(dimethylamino)-1-methylethyl]-.alpha.-ethyl-.beta.-phenyl-, hydrochloride
| Molecular Formula | C21H30ClNO |
| Molecular Weight | 347.2016 g/mol |
| XLogP | -0.47 |
| Topological Polar Surface Area (TPSA) | 24.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.2016 Da |
| Heavy Atoms | 24 |
| Complexity | 311.0 |
| SMILES | CCC(C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[NH+](C)C)O.[Cl-] |
| InChIKey | SSBDRUWRKMHEKG-UHFFFAOYSA-N |
The XLogP value of -0.47 indicates that 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.7 Ų, 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride has 2 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 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride is 63765-81-1.
The molecular formula of 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride is C21H30ClNO.
The molecular weight of 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanol hydrochloride is 347.2016 g/mol.
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