1,5-Isoquinolinediol
TL;DR: 1,5-Isoquinolinediol (CAS 5154-02-9) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.04768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hydroxy-2H-isoquinolin-1-one
Also Known As: 1,5-isoquinolinediol, isoquinoline-1,5-diol, 1,5-Dihydroxyisoquinoline, isoquinolinediol, 5-HYDROXYISOQUINOLINE-1(2H)-ONE
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H7NO2 |
| Molecular Weight | 161.04768 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.04768 Da |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
| SMILES | C1=CC2=C(C=CNC2=O)C(=C1)O |
| InChIKey | LFUJIPVWTMGYDG-UHFFFAOYSA-N |
Product Description
Applications: 1,5-Isoquinolinediol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,5-Isoquinolinediol (CAS 5154-02-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1,5-Isoquinolinediol is a pharmaceutical intermediate identified by CAS number 5154-02-9 and the molecular formula C9H7NO2 and a molecular weight of 161.05 g/mol. It is also known as 1,5-isoquinolinediol and isoquinoline-1,5-diol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1,5-Isoquinolinediol
Property Insights of 1,5-Isoquinolinediol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Isoquinolinediol. With a topological polar surface area (TPSA) of 49.3 Ų, 1,5-Isoquinolinediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Isoquinolinediol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,5-Isoquinolinediol?
The CAS number of 1,5-Isoquinolinediol is 5154-02-9.
What is the molecular formula of 1,5-Isoquinolinediol?
The molecular formula of 1,5-Isoquinolinediol is C9H7NO2.
What is the molecular weight of 1,5-Isoquinolinediol?
The molecular weight of 1,5-Isoquinolinediol is 161.04768 g/mol.
What are the applications of 1,5-Isoquinolinediol?
1,5-Isoquinolinediol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,5-Isoquinolinediol (CAS...
Where can I buy 1,5-Isoquinolinediol?
You can request a quote for 1,5-Isoquinolinediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,5-Isoquinolinediol?
Yes, CoreyChem provides custom synthesis services for 1,5-Isoquinolinediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.