1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol
TL;DR: 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol (CAS 15052-02-5) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrahydroisoquinoline-4,5,8-triol
Also Known As: 1,2,3,4-tetrahydroisoquinoline-4,5,8-triol, 1,2,3,4-tetrahydro-isoquinoline-4,5,8-triol
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 15052-02-5 |
|---|---|
| SMILES | C1C(C2=C(C=CC(=C2CN1)O)O)O |
| InChIKey | LQGQUVMXXUHCST-UHFFFAOYSA-N |
Product Overview
1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol (CAS 15052-02-5), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: 1,2,3,4-tetrahydroisoquinoline-4,5,8-triol.
Chemical Property Profile of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol
Property Insights of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol
The XLogP value of -0.5 indicates that 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol has 4 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-isoquinoline-4,5,8-triol?
The CAS number of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol is 15052-02-5.
What is the molecular formula of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol?
The molecular formula of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol is C9H11NO3.
What is the molecular weight of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol?
The molecular weight of 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol is 181.07 g/mol.
Where can I buy 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol?
You can request a quote for 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol 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-isoquinoline-4,5,8-triol?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydro-isoquinoline-4,5,8-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.