alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride
TL;DR: alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride (CAS 5591-29-7) is a chemical compound with molecular formula C12H20ClNO and molecular weight 229.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethyl(methyl)amino]-1-phenylpropan-1-ol;hydrochloride
Also Known As: Etafedrine hydrochloride, Etafedrine HCl, Nethamine, Ditenate, Nethaphyl
| Molecular Formula | C12H20ClNO |
|---|---|
| Molecular Weight | 229.12 g/mol |
| LogP | 2.48 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.12334 |
| Heavy Atoms | 15 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 5591-29-7 |
|---|---|
| SMILES | CCN(C)C(C)C(C1=CC=CC=C1)O.Cl |
| InChIKey | WRONACHIHQGZSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride (CAS 5591-29-7), with molecular formula C12H20ClNO and molecular weight 229.12 g/mol. IUPAC: 2-[ethyl(methyl)amino]-1-phenylpropan-1-ol;hydrochloride.
Chemical Property Profile of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride
Property Insights of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride
The XLogP value of 2.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride. With a topological polar surface area (TPSA) of 24.7 Ų, alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride has 2 hydrogen bond donor(s) and 2 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 alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride?
The CAS number of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride is 5591-29-7.
What is the molecular formula of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride?
The molecular formula of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride is C12H20ClNO.
What is the molecular weight of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride?
The molecular weight of alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride is 229.12 g/mol.
Where can I buy alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride?
You can request a quote for alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for alpha-(1-(Ethylmethylamino)ethyl)benzyl alcohol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.