Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)
TL;DR: Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) (CAS 6318-73-6) is a chemical compound with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pentyl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride
Also Known As: 3,4-Dihydro-6,7-dihydroxy-2-amylisoquinolinium chloride, 3,4-Dihydro-6,7-dihydroxy-2-pentylisoquinolinium chloride, ISOQUINOLINIUM, 3,4-DIHYDRO-6,7-DIHYDROXY-2-PENTYL-, CHLORIDE, 2-pentyl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride, 2-pentyl-3,4-dihydroisoquinolin-2-ium-6,7-diol,chloride
| Molecular Formula | C14H20ClNO2 |
|---|---|
| Molecular Weight | 269.12 g/mol |
| LogP | -0.72 |
| Topological Polar Surface Area | 43.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.11826 |
| Heavy Atoms | 18 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 6318-73-6 |
|---|---|
| SMILES | CCCCC[N+]1=CC2=CC(=C(C=C2CC1)O)O.[Cl-] |
| InChIKey | LPSZIENOLKNQIZ-UHFFFAOYSA-N |
Product Overview
Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) (CAS 6318-73-6), with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol. IUPAC: 2-pentyl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride.
Chemical Property Profile of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)
Property Insights of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)
The XLogP value of -0.72 indicates that Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.5 Ų, Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) 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 Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)?
The CAS number of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) is 6318-73-6.
What is the molecular formula of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)?
The molecular formula of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) is C14H20ClNO2.
What is the molecular weight of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)?
The molecular weight of Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) is 269.12 g/mol.
Where can I buy Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)?
You can request a quote for Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 3,4-dihydro-6,7-dihydroxy-2-pentyl-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.