(6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid
TL;DR: (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid (CAS 68345-67-5) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid
Also Known As: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic Acid, (6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid, 3-Methoxy-4-nitrophenol, 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline-1-acetic acid, (6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-acetic acid
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 1.3653 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 458.54962 |
Chemical Identifiers
| CAS Number | 68345-67-5 |
|---|---|
| SMILES | COC1=C(C=C2C(NCCC2=C1)CC(=O)O)OC |
Product Overview
(6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid (CAS 68345-67-5), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid.
Chemical Property Profile of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid
Property Insights of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid
The XLogP value of 1.3653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid. Following Lipinski's Rule of Five, (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid has 2 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 (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid?
The CAS number of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid is 68345-67-5.
What is the molecular formula of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid?
The molecular formula of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid is C13H17NO4.
What is the molecular weight of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid?
The molecular weight of (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid is 251.12 g/mol.
Where can I buy (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid?
You can request a quote for (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.