Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)
TL;DR: Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) (CAS 63589-38-8) is a chemical compound with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-ethylanilino)ethyl acetate;hydrochloride
Also Known As: Ethanol, 2-(ethylphenylamino)-, acetate (ester), hydrochloride, 2-(N-ethylanilino)ethyl acetate hydrochloride, 2-[ethyl(phenyl)amino]ethyl acetate hydrochloride(1:1), Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1), 2-[Ethyl(phenyl)amino]ethyl acetate--hydrogen chloride (1/1)
| Molecular Formula | C12H18ClNO2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 243.1026 |
| Heavy Atoms | 16 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 63589-38-8 |
|---|---|
| SMILES | CCN(CCOC(=O)C)C1=CC=CC=C1.Cl |
| InChIKey | ARXZQTMHATXXON-UHFFFAOYSA-N |
Product Overview
Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) (CAS 63589-38-8), with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol. IUPAC: 2-(N-ethylanilino)ethyl acetate;hydrochloride.
Chemical Property Profile of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)
Property Insights of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1). With a topological polar surface area (TPSA) of 29.5 Ų, Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) has 1 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 Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)?
The CAS number of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) is 63589-38-8.
What is the molecular formula of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)?
The molecular formula of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) is C12H18ClNO2.
What is the molecular weight of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)?
The molecular weight of Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) is 243.10 g/mol.
Where can I buy Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)?
You can request a quote for Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-(ethylphenylamino)-, 1-acetate, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.