TL;DR: 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) (CAS 35158-64-6) is a chemical compound with molecular formula C13H20ClNO4 and molecular weight 289.1081 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(3-methoxyphenoxy)acetyl]oxyethyl-dimethylazanium chloride
Also Known As: (m-Methoxyphenoxy)acetic acid 2-(dimethylamino)ethyl ester hydrochloride, N,N-Dimethylaminoethyl m-methoxyphenoxyacetate hydrochloride, 2-[2-(3-methoxyphenoxy)acetyl]oxyethyl-dimethylazanium chloride, ACETIC ACID, (m-METHOXYPHENOXY)-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE, 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1)
| Molecular Formula | C13H20ClNO4 |
| Molecular Weight | 289.1081 g/mol |
| XLogP | -3.23 |
| Topological Polar Surface Area (TPSA) | 49.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 289.1081 Da |
| Heavy Atoms | 19 |
| Complexity | 245.0 |
| SMILES | C[NH+](C)CCOC(=O)COC1=CC=CC(=C1)OC.[Cl-] |
| InChIKey | LAGUJVPOOUPWGF-UHFFFAOYSA-N |
The XLogP value of -3.23 indicates that 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.2 Ų, 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) is 35158-64-6.
The molecular formula of 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) is C13H20ClNO4.
The molecular weight of 2-(Dimethylamino)ethyl (3-methoxyphenoxy)acetate--hydrogen chloride (1/1) is 289.1081 g/mol.
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