Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride
TL;DR: Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride (CAS 101866-46-0) is a chemical compound with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(dimethylamino)methyl]-1-methylcyclohexyl] benzoate;hydrochloride
Also Known As: 2-((Dimethylamino)methyl)-1-methylcyclohexanol benzoate hydrochloride, Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride, [2-(dimethylaminomethyl)-1-methylcyclohexyl] benzoate hydrochloride, 2-[(Dimethylamino)methyl]-1-methylcyclohexyl benzoate--hydrogen chloride (1/1), RefChem:335473
| Molecular Formula | C17H26ClNO2 |
|---|---|
| Molecular Weight | 311.17 g/mol |
| LogP | 3.7757 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.1652 |
| Heavy Atoms | 21 |
| Complexity | 449.36316 |
Chemical Identifiers
| CAS Number | 101866-46-0 |
|---|---|
| SMILES | CC1(CCCCC1CN(C)C)OC(=O)C2=CC=CC=C2.Cl |
Product Overview
Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride (CAS 101866-46-0), with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol. IUPAC: [2-[(dimethylamino)methyl]-1-methylcyclohexyl] benzoate;hydrochloride.
Chemical Property Profile of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride
Property Insights of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride
The XLogP value of 3.7757 indicates that Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride?
The CAS number of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride is 101866-46-0.
What is the molecular formula of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride?
The molecular formula of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride is C17H26ClNO2.
What is the molecular weight of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride?
The molecular weight of Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride is 311.17 g/mol.
Where can I buy Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride?
You can request a quote for Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanol, 2-((dimethylamino)methyl)-1-methyl-, benzoate, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.