1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-
TL;DR: 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- (CAS 135420-19-8) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-hydroxy-4-(methylamino)phenyl]-3-methylpentan-1-one
Also Known As: 1-(3-Hydroxy-4-(methylamino)phenyl)-3-methyl-1-pentanone, 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-, 1-[3-hydroxy-4-(methylamino)phenyl]-3-methylpentan-1-one, BRN 4311144
Technical Specifications
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.14159 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.14159 Da |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
| SMILES | CCC(C)CC(=O)C1=CC(=C(C=C1)NC)O |
| InChIKey | FPYVHUMVZLNWJD-UHFFFAOYSA-N |
Chemical Property Profile of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-
Property Insights of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-
The XLogP value of 3.0 indicates that 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- 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
What is the CAS number of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-?
The CAS number of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- is 135420-19-8.
What is the molecular formula of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-?
The molecular formula of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- is C13H19NO2.
What is the molecular weight of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-?
The molecular weight of 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- is 221.14159 g/mol.
Where can I buy 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-?
You can request a quote for 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl-?
Yes, CoreyChem provides custom synthesis services for 1-Pentanone, 1-(3-hydroxy-4-(methylamino)phenyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.