Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride
TL;DR: Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride (CAS 6274-99-3) is a chemical compound with molecular formula C13H20ClNO2 and molecular weight 257.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium chloride
Also Known As: 1,2,3,4-Tetrahydro-6,7-dimethoxy-2,2-dimethylisoquinolinium chloride, ISOQUINOLINIUM, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2,2-DIMETHYL-, CHLORIDE, 6,7-Dimethoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride, 6,7-dimethoxy-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium chloride, RefChem:1087793
| Molecular Formula | C13H20ClNO2 |
|---|---|
| Molecular Weight | 257.12 g/mol |
| LogP | -1.16 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.11826 |
| Heavy Atoms | 17 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 6274-99-3 |
|---|---|
| SMILES | C[N+]1(CCC2=CC(=C(C=C2C1)OC)OC)C.[Cl-] |
| InChIKey | CKUAAIFYQGZEGE-UHFFFAOYSA-M |
Product Overview
Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride (CAS 6274-99-3), with molecular formula C13H20ClNO2 and molecular weight 257.12 g/mol. IUPAC: 6,7-dimethoxy-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium chloride.
Chemical Property Profile of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride
Property Insights of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride
The XLogP value of -1.16 indicates that Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 18.5 Ų, Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride has 0 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, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride?
The CAS number of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride is 6274-99-3.
What is the molecular formula of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride?
The molecular formula of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride is C13H20ClNO2.
What is the molecular weight of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride?
The molecular weight of Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride is 257.12 g/mol.
Where can I buy Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride?
You can request a quote for Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 1,2,3,4-tetrahydro-6,7-dimethoxy-2,2-dimethyl-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.