![3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol structure](/static/products/1591/159152-82-6.webp)
3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol
TL;DR: 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol (CAS 159152-82-6) is a chemical compound with molecular formula C8H10F3NO2 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-2,1-benzoxazol-3-ol
Also Known As: starbld0038638, 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol, 3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-2,1-benzoxazol-3-ol, 3,4,5,6,6a,7-hexahydro-7-hydroxy-7-(trifluoromethyl)benz-[c]-isoxazole, 3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2,1-benzoxazol-3-ol
| Molecular Formula | C8H10F3NO2 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 1.8137 |
| Topological Polar Surface Area | 41.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.06636 |
| Heavy Atoms | 14 |
| Complexity | 276.25018 |
Chemical Identifiers
| CAS Number | 159152-82-6 |
|---|---|
| SMILES | C1CCC2=NOC(C2C1)(C(F)(F)F)O |
Product Overview
3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol (CAS 159152-82-6), with molecular formula C8H10F3NO2 and molecular weight 209.07 g/mol. IUPAC: 3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-2,1-benzoxazol-3-ol.
Chemical Property Profile of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol
Property Insights of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol
The XLogP value of 1.8137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol. With a topological polar surface area (TPSA) of 41.82 Ų, 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol 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
Frequently Asked Questions
What is the CAS number of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol?
The CAS number of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol is 159152-82-6.
What is the molecular formula of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol?
The molecular formula of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol is C8H10F3NO2.
What is the molecular weight of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol?
The molecular weight of 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol is 209.07 g/mol.
Where can I buy 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol?
You can request a quote for 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Trifluoromethyl-3,3a,4,5,6,7-hexahydrobenzo[c]isoxazol-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.