2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
TL;DR: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol (CAS 16232-61-4) is a chemical compound with molecular formula C11H21NO and molecular weight 183.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
Also Known As: 2-ethyl-decahydro-isoquinolin-5-ol, cis-2-Ethyldecahydro-5-isoquinolinol, 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
| Molecular Formula | C11H21NO |
|---|---|
| Molecular Weight | 183.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.16231 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 16232-61-4 |
|---|---|
| SMILES | CCN1CCC2C(C1)CCCC2O |
| InChIKey | SIIVDVCPUJLGRR-UHFFFAOYSA-N |
Product Overview
2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol (CAS 16232-61-4), with molecular formula C11H21NO and molecular weight 183.16 g/mol. IUPAC: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol.
Chemical Property Profile of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
Property Insights of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol. With a topological polar surface area (TPSA) of 23.5 Ų, 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol has 1 hydrogen bond donor(s) and 2 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 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol?
The CAS number of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol is 16232-61-4.
What is the molecular formula of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol?
The molecular formula of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol is C11H21NO.
What is the molecular weight of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol?
The molecular weight of 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol is 183.16 g/mol.
Where can I buy 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol?
You can request a quote for 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.