Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride
TL;DR: Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride (CAS 5884-29-7) is a chemical compound with molecular formula C12H16ClNO2 and molecular weight 241.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-3-methyl-3,4-dihydroisoquinolin-2-ium chloride
Also Known As: 6,7-dimethoxy-3-methyl-3,4-dihydroisoquinoline Hydrochloride, 3,4-Dihydro-6,7-dimethoxy-3-methylisoquinoline hydrochloride, ISOQUINOLINE, 3,4-DIHYDRO-6,7-DIMETHOXY-3-METHYL-, HYDROCHLORIDE, 6,7-Dimethoxy-3-methyl-3,4-dihydro-isochinolin,Hydrochlorid, 6,7-dimethoxy-3-methyl-3,4-dihydroisoquinolin-2-ium chloride
| Molecular Formula | C12H16ClNO2 |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | -2.85 |
| Topological Polar Surface Area | 32.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.08696 |
| Heavy Atoms | 16 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 5884-29-7 |
|---|---|
| SMILES | CC1CC2=CC(=C(C=C2C=[NH+]1)OC)OC.[Cl-] |
| InChIKey | CNSFEYAWSFOOSN-UHFFFAOYSA-N |
Product Overview
Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride (CAS 5884-29-7), with molecular formula C12H16ClNO2 and molecular weight 241.09 g/mol. IUPAC: 6,7-dimethoxy-3-methyl-3,4-dihydroisoquinolin-2-ium chloride.
Chemical Property Profile of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride
Property Insights of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride
The XLogP value of -2.85 indicates that Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.4 Ų, Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride has 1 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 Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride?
The CAS number of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride is 5884-29-7.
What is the molecular formula of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride?
The molecular formula of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride is C12H16ClNO2.
What is the molecular weight of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride?
The molecular weight of Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride is 241.09 g/mol.
Where can I buy Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride?
You can request a quote for Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 3,4-dihydro-6,7-dimethoxy-3-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.