TL;DR: m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride (CAS 96731-12-3) is a chemical compound with molecular formula C12H20Cl2N2O2 and molecular weight 294.09018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxyphenyl]azanium chloride
Also Known As: 5-Chloro-4-(3-(dimethylamino)propoxy)-m-anisidine hydrochloride, m-ANISIDINE, 5-CHLORO-4-(3-(DIMETHYLAMINO)PROPOXY)-, HYDROCHLORIDE, [3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxyphenyl]azanium chloride
| Molecular Formula | C12H20Cl2N2O2 |
| Molecular Weight | 294.09018 g/mol |
| XLogP | -1.44 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.09018 Da |
| Heavy Atoms | 18 |
| Complexity | 217.0 |
| SMILES | CN(C)CCCOC1=C(C=C(C=C1Cl)[NH3+])OC.[Cl-] |
| InChIKey | RYECZOFVKSMHES-UHFFFAOYSA-N |
The XLogP value of -1.44 indicates that m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride is 96731-12-3.
The molecular formula of m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride is C12H20Cl2N2O2.
The molecular weight of m-Anisidine, 5-chloro-4-(3-(dimethylamino)propoxy)-, hydrochloride is 294.09018 g/mol.
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