(R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
TL;DR: (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (CAS 104974-47-2) is a chemical compound with molecular formula C10H9NO3 and molecular weight 191.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylic acid
Also Known As: (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, (3R)-1,2,3,4-Tetrahydro-1-oxo-3-isoquinolinecarboxylic acid, 1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylic Acid, (3R)-1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylic acid, (3R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Technical Specifications
| Molecular Formula | C10H9NO3 |
| Molecular Weight | 191.05824 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.05824 Da |
| Heavy Atoms | 14 |
| Complexity | 264.0 |
| SMILES | C1[C@@H](NC(=O)C2=CC=CC=C21)C(=O)O |
| InChIKey | YXSGIZSINDRUBG-MRVPVSSYSA-N |
Chemical Property Profile of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Property Insights of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid has 2 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 (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid?
The CAS number of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid is 104974-47-2.
What is the molecular formula of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid?
The molecular formula of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid is C10H9NO3.
What is the molecular weight of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid?
The molecular weight of (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid is 191.05824 g/mol.
Where can I buy (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid?
You can request a quote for (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (R)-1-Oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.