Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride
TL;DR: Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride (CAS 63905-65-7) is a chemical compound with molecular formula C13H20ClNO2 and molecular weight 257.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Also Known As: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolinium chloride, 6,7-Diethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride, 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium chloride, ISOQUINOLINE, 6,7-DIETHOXY-1,2,3,4-TETRAHYDRO-, HYDROCHLORIDE, NSC 26634
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H20ClNO2 |
| Molecular Weight | 257.11826 g/mol |
| XLogP | -1.89 |
| Topological Polar Surface Area (TPSA) | 35.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.11826 Da |
| Heavy Atoms | 17 |
| Complexity | 210.0 |
| SMILES | CCOC1=C(C=C2C[NH2+]CCC2=C1)OCC.[Cl-] |
| InChIKey | GXDZORNOMJIKNT-UHFFFAOYSA-N |
Chemical Property Profile of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride
Property Insights of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride
The XLogP value of -1.89 indicates that Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.1 Ų, Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, 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
What is the CAS number of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride?
The CAS number of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride is 63905-65-7.
What is the molecular formula of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride?
The molecular formula of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride is C13H20ClNO2.
What is the molecular weight of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride?
The molecular weight of Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride is 257.11826 g/mol.
Where can I buy Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride?
You can request a quote for Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Isoquinoline, 6,7-diethoxy-1,2,3,4-tetrahydro-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.