ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
TL;DR: ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate (CAS 106181-28-6) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Also Known As: ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate, (R)-1,2,3,4-Tetrahydro-isoquinoline-1-carboxylic acid ethyl ester, BAS 02785782, (R)-Ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate, J2.496.804I
Technical Specifications
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.11028 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 Da |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
| SMILES | CCOC(=O)[C@H]1C2=CC=CC=C2CCN1 |
| InChIKey | OOIVWSXZWFQHQS-LLVKDONJSA-N |
Chemical Property Profile of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Property Insights of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate. With a topological polar surface area (TPSA) of 38.3 Ų, ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate has 1 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 ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The CAS number of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is 106181-28-6.
What is the molecular formula of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The molecular formula of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is C12H15NO2.
What is the molecular weight of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The molecular weight of ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate is 205.11028 g/mol.
Where can I buy ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
You can request a quote for ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.