Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)
TL;DR: Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) (CAS 67828-68-6) is a chemical compound with molecular formula C9H12ClNO2 and molecular weight 201.05565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-hydroxyphenyl)-2-(methylamino)ethanone;hydrochloride
Also Known As: Adrenaline Impurity 21, Adrenaline Impurity 8 HCl, Adrenaline Impurity 18 HCl, Adrenaline Impurity 8 (HCl), 1-(4-Hydroxyphenyl)-2-(methylamino)ethan-1-one hydrochloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12ClNO2 |
| Molecular Weight | 201.05565 g/mol |
| XLogP | 1.22 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.05565 Da |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
| SMILES | CNCC(=O)C1=CC=C(C=C1)O.Cl |
| InChIKey | FKGNVJPOAYAVNM-UHFFFAOYSA-N |
Chemical Property Profile of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)
Property Insights of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)
The XLogP value of 1.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 49.3 Ų, Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)?
The CAS number of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) is 67828-68-6.
What is the molecular formula of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)?
The molecular formula of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) is C9H12ClNO2.
What is the molecular weight of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)?
The molecular weight of Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) is 201.05565 g/mol.
Where can I buy Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)?
You can request a quote for Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1)?
Yes, CoreyChem provides custom synthesis services for Ethanone, 1-(4-hydroxyphenyl)-2-(methylamino)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.