Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-
TL;DR: Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- (CAS 101858-32-6) is a chemical compound with molecular formula C11H15F6NO2 and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,8,8-trifluoro-7-hydroxy-6-(1-hydroxyethyl)-7-(trifluoromethyl)octanenitrile
Also Known As: 7-Hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)octanenitrile, 8,8,8-trifluoro-7-hydroxy-6-(1-hydroxyethyl)-7-(trifluoromethyl)octanenitrile, OCTANENITRILE, 7-HYDROXY-6-(1,1,1,3,3,3-HEXAFLUORO-2-HYDROXY-2-PROPYL)-, 2-Hydroxy-3-(1-hydroxy-2,2,2-trifluoro-1-trifluoromethyl)ethyl octanenitrile, Octanenitrile, 8,8,8-trifluoro-7-hydroxy-6-(1-hydroxyethyl)-7-(trifluoromethyl)-
| Molecular Formula | C11H15F6NO2 |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.1007 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 101858-32-6 |
|---|---|
| SMILES | CC(C(CCCCC#N)C(C(F)(F)F)(C(F)(F)F)O)O |
| InChIKey | FNRJWAUAFAMIGN-UHFFFAOYSA-N |
Product Overview
Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- (CAS 101858-32-6), with molecular formula C11H15F6NO2 and molecular weight 307.10 g/mol. IUPAC: 8,8,8-trifluoro-7-hydroxy-6-(1-hydroxyethyl)-7-(trifluoromethyl)octanenitrile.
Chemical Property Profile of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-
Property Insights of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-. Following Lipinski's Rule of Five, Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- has 2 hydrogen bond donor(s) and 9 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 Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-?
The CAS number of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- is 101858-32-6.
What is the molecular formula of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-?
The molecular formula of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- is C11H15F6NO2.
What is the molecular weight of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-?
The molecular weight of Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- is 307.10 g/mol.
Where can I buy Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-?
You can request a quote for Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-?
Yes, KEHONG BIO provides custom synthesis services for Octanenitrile, 7-hydroxy-6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.