TL;DR: Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride (CAS 101491-76-3) is a chemical compound with molecular formula C8H11ClN2O2 and molecular weight 202.0509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridin-1-ium-2-yl N,N-dimethylcarbamate chloride
Also Known As: 2-Pyridyl dimethylcarbamate hydrochloride, pyridin-2-ylN,N-dimethylcarbamate, CARBAMIC ACID, DIMETHYL-, 2-PYRIDYL ESTER, HYDROCHLORIDE, 2-[(dimethylcarbamoyl)oxy]pyridinium chloride, N,N-Dimethylcarbamic acid 2-pyridyl ester hydrochloride
| Molecular Formula | C8H11ClN2O2 |
| Molecular Weight | 202.0509 g/mol |
| XLogP | -2.43 |
| Topological Polar Surface Area (TPSA) | 43.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.0509 Da |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
| SMILES | CN(C)C(=O)OC1=CC=CC=[NH+]1.[Cl-] |
| InChIKey | XMPAAUQMEHXKFZ-UHFFFAOYSA-N |
The XLogP value of -2.43 indicates that Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.7 Ų, Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride has 1 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 Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride is 101491-76-3.
The molecular formula of Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride is C8H11ClN2O2.
The molecular weight of Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride is 202.0509 g/mol.
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