1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline
TL;DR: 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline (CAS 73058-52-3) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7,8-trimethoxy-1,2,3,4-tetrahydroisoquinoline
Also Known As: Anhalinine, 6,7,8-Trimethoxy-1,2,3,4-tetrahydroisoquinoline, 1,2,3,4-tetrahydro-6,7,8-trimethoxyisoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-6,7,8-trimethoxy-, 6,7,8-trimethoxytetrahydroisoquinoline
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 39.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 73058-52-3 |
|---|---|
| SMILES | COC1=C(C(=C2CNCCC2=C1)OC)OC |
| InChIKey | GOBKARNYNSWQFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline (CAS 73058-52-3), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 6,7,8-trimethoxy-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline
Property Insights of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline. With a topological polar surface area (TPSA) of 39.7 Ų, 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline has 1 hydrogen bond donor(s) and 4 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 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline?
The CAS number of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline is 73058-52-3.
What is the molecular formula of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline?
The molecular formula of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline is C12H17NO3.
What is the molecular weight of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline?
The molecular weight of 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline is 223.12 g/mol.
Where can I buy 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline?
You can request a quote for 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydro-6,7,8-trimethoxyisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.