TL;DR: C14H20ClNO2.BrH (CAS 63766-12-1) is a chemical compound with molecular formula C14H21BrClNO2 and molecular weight 349.04443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(6-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-hydroxymethyl]-dimethylazanium bromide
Also Known As: [(6-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-hydroxymethyl]-dimethylazanium bromide|1-Naphthalenemethanol, 1,2,3,4-tetrahydro-6-chloro-1-(dimethylamino)-5-methoxy-, hydrobromide|1-NAPHTHALENEMETHANOL, 1,2,3,4-TETRAHYDRO-6-CHLORO-1-(DIMETHYLAMINO)-5-METHOXY-,|(6-Chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)(dimethylamino)methanol--hydrogen bromide (1/1)|1-Naphthalenemethanol, 6-chloro-1-(dimethylamino)-1,2,3,4-tetrahydro-5-methoxy-, hydrobromide
| Molecular Formula | C14H21BrClNO2 |
| Molecular Weight | 349.04443 g/mol |
| XLogP | -1.76 |
| Topological Polar Surface Area (TPSA) | 33.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.04443 Da |
| Heavy Atoms | 19 |
| Complexity | 275.0 |
| SMILES | C[NH+](C)C(C1CCCC2=C1C=CC(=C2OC)Cl)O.[Br-] |
| InChIKey | PKFLRMGRLBJGHH-UHFFFAOYSA-N |
The XLogP value of -1.76 indicates that C14H20ClNO2.BrH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.9 Ų, C14H20ClNO2.BrH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C14H20ClNO2.BrH has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C14H20ClNO2.BrH is 63766-12-1.
The molecular formula of C14H20ClNO2.BrH is C14H21BrClNO2.
The molecular weight of C14H20ClNO2.BrH is 349.04443 g/mol.
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