![1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- structure](/static/products/6542/65427-91-0.webp)
1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-
TL;DR: 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- (CAS 65427-91-0) is a chemical compound with molecular formula C17H17NO6 and molecular weight 331.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dihydroxyphenyl)methyl]-6,7-dihydroxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
Also Known As: 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-, 1-(3,4-Dihydroxybenzyl)-6,7-dihydroxy-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid, 1-(3,4-Dihydroxybenzyl)-6,7-dihydroxy-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid #, 1-[(3,4-dihydroxyphenyl)methyl]-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid, 1-[(3,4-dihydroxyphenyl)methyl]-6,7-dihydroxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
| Molecular Formula | C17H17NO6 |
|---|---|
| Molecular Weight | 331.11 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.1056 |
| Heavy Atoms | 24 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 65427-91-0 |
|---|---|
| SMILES | C1CNC(C2=CC(=C(C=C21)O)O)(CC3=CC(=C(C=C3)O)O)C(=O)O |
| InChIKey | WFSIJSYETMGYCQ-UHFFFAOYSA-N |
Product Overview
1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- (CAS 65427-91-0), with molecular formula C17H17NO6 and molecular weight 331.11 g/mol. IUPAC: 1-[(3,4-dihydroxyphenyl)methyl]-6,7-dihydroxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid.
Chemical Property Profile of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-
Property Insights of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-
The XLogP value of -0.8 indicates that 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-?
The CAS number of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- is 65427-91-0.
What is the molecular formula of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-?
The molecular formula of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- is C17H17NO6.
What is the molecular weight of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-?
The molecular weight of 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- is 331.11 g/mol.
Where can I buy 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-?
You can request a quote for 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- 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-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydroisoquinolin-6,7-diol,1-carboxy-1-[3,4-hydroxybenzyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.