异喹啉-5-醇盐酸盐(1/1)
TL;DR: 异喹啉-5-醇盐酸盐(1/1) (CAS 20941-60-0) is a chemical compound with molecular formula C9H8ClNO and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异喹啉-5-醇盐酸盐(1/1)
isoquinolin-2-ium-5-ol chloride
Also Known As: 2H-isoquinolin-5-ol Chloride, isoquinolin-2-ium-5-ol chloride, 5-ISOQUINOLINOL, HYDROCHLORIDE, Isoquinolin-5-ol--hydrogen chloride (1/1), RefChem:1087695
| Molecular Formula | C9H8ClNO |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | -1.64 |
| Topological Polar Surface Area | 34.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.02943 |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 20941-60-0 |
|---|---|
| SMILES | C1=CC2=C(C=C[NH+]=C2)C(=C1)O.[Cl-] |
| InChIKey | LETXYWLLKRSZMZ-UHFFFAOYSA-N |
Product Overview
异喹啉-5-醇盐酸盐(1/1) (CAS 20941-60-0), with molecular formula C9H8ClNO and molecular weight 181.03 g/mol. IUPAC: isoquinolin-2-ium-5-ol chloride.
Chemical Property Profile of 异喹啉-5-醇盐酸盐(1/1)
Property Insights of 异喹啉-5-醇盐酸盐(1/1)
The XLogP value of -1.64 indicates that 异喹啉-5-醇盐酸盐(1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.4 Ų, 异喹啉-5-醇盐酸盐(1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异喹啉-5-醇盐酸盐(1/1) 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
Frequently Asked Questions
What is the CAS number of 异喹啉-5-醇盐酸盐(1/1)?
The CAS number of 异喹啉-5-醇盐酸盐(1/1) is 20941-60-0.
What is the molecular formula of 异喹啉-5-醇盐酸盐(1/1)?
The molecular formula of 异喹啉-5-醇盐酸盐(1/1) is C9H8ClNO.
What is the molecular weight of 异喹啉-5-醇盐酸盐(1/1)?
The molecular weight of 异喹啉-5-醇盐酸盐(1/1) is 181.03 g/mol.
Where can I buy 异喹啉-5-醇盐酸盐(1/1)?
You can request a quote for 异喹啉-5-醇盐酸盐(1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异喹啉-5-醇盐酸盐(1/1)?
Yes, KEHONG BIO provides custom synthesis services for 异喹啉-5-醇盐酸盐(1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.