1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone
TL;DR: 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone (CAS 121-28-8) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)ethanone
Also Known As: Isoproterenone, Aludrone, N-Isopropylnoradrenalone, Isoproterenon, Norepinephrine Impurity 36
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 121-28-8 |
|---|---|
| SMILES | CC(C)NCC(=O)C1=CC(=C(C=C1)O)O |
| InChIKey | BIQMIYWSZZTXEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone (CAS 121-28-8), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)ethanone.
Chemical Property Profile of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone
Property Insights of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone. Following Lipinski's Rule of Five, 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone has 3 hydrogen bond donor(s) and 4 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 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone?
The CAS number of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone is 121-28-8.
What is the molecular formula of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone?
The molecular formula of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone is C11H15NO3.
What is the molecular weight of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone?
The molecular weight of 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone is 209.11 g/mol.
Where can I buy 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone?
You can request a quote for 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.