1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-
TL;DR: 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- (CAS 123172-48-5) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-hydroxy-4-(methylamino)phenyl]butan-1-one
Also Known As: 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-, 1-(3-Hydroxy-4-(methylamino)phenyl)-1-butanone, 1-[3-hydroxy-4-(methylamino)phenyl]butan-1-one, BRN 4309574, RefChem:228831
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 2.4167 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 334.05945 |
Chemical Identifiers
| CAS Number | 123172-48-5 |
|---|---|
| SMILES | CCCC(=O)C1=CC(=C(C=C1)NC)O |
Product Overview
1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- (CAS 123172-48-5), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 1-[3-hydroxy-4-(methylamino)phenyl]butan-1-one.
Chemical Property Profile of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-
Property Insights of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-
The XLogP value of 2.4167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-. With a topological polar surface area (TPSA) of 49.33 Ų, 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- has 2 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 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-?
The CAS number of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- is 123172-48-5.
What is the molecular formula of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-?
The molecular formula of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- is C11H15NO2.
What is the molecular weight of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-?
The molecular weight of 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- is 193.11 g/mol.
Where can I buy 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-?
You can request a quote for 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-(3-hydroxy-4-(methylamino)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.