1-Methylisoquinolin-3-ol
TL;DR: 1-Methylisoquinolin-3-ol (CAS 16535-99-2) is a chemical compound with molecular formula C10H9NO and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2H-isoquinolin-3-one
Also Known As: 1-methylisoquinolin-3-ol, 1-methyl-2H-isoquinolin-3-one, 1-Methylisoquinolin-3(2H)-one, 1-methyl-3-isoquinolone, 3-hydroxy-1-methylisoquinoline
| Molecular Formula | C10H9NO |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 1.83652 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.06842 |
| Heavy Atoms | 12 |
| Complexity | 470.46744 |
Chemical Identifiers
| CAS Number | 16535-99-2 |
|---|---|
| SMILES | CC1=C2C=CC=CC2=CC(=O)N1 |
Product Overview
1-Methylisoquinolin-3-ol (CAS 16535-99-2), with molecular formula C10H9NO and molecular weight 159.07 g/mol. IUPAC: 1-methyl-2H-isoquinolin-3-one.
Chemical Property Profile of 1-Methylisoquinolin-3-ol
Property Insights of 1-Methylisoquinolin-3-ol
The XLogP value of 1.83652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylisoquinolin-3-ol. With a topological polar surface area (TPSA) of 32.86 Ų, 1-Methylisoquinolin-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylisoquinolin-3-ol has 1 hydrogen bond donor(s) and 1 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-Methylisoquinolin-3-ol?
The CAS number of 1-Methylisoquinolin-3-ol is 16535-99-2.
What is the molecular formula of 1-Methylisoquinolin-3-ol?
The molecular formula of 1-Methylisoquinolin-3-ol is C10H9NO.
What is the molecular weight of 1-Methylisoquinolin-3-ol?
The molecular weight of 1-Methylisoquinolin-3-ol is 159.07 g/mol.
Where can I buy 1-Methylisoquinolin-3-ol?
You can request a quote for 1-Methylisoquinolin-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylisoquinolin-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylisoquinolin-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.