3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol
TL;DR: 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol (CAS 187812-06-2) is a chemical compound with molecular formula C10H7ClF3NO2 and molecular weight 265.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-5-ol
Also Known As: BAS 05605377, 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol, 3-(4-chlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-5-ol, 3-(4-chlorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-5-ol, 3-(4-chlorophenyl)-5-(trifluoromethyl)-4,5-dihydro-1,2-oxazol-5-ol
| Molecular Formula | C10H7ClF3NO2 |
|---|---|
| Molecular Weight | 265.01 g/mol |
| LogP | 2.7153 |
| Topological Polar Surface Area | 41.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 265.01175 |
| Heavy Atoms | 17 |
| Complexity | 457.61398 |
Chemical Identifiers
| CAS Number | 187812-06-2 |
|---|---|
| SMILES | C1C(=NOC1(C(F)(F)F)O)C2=CC=C(C=C2)Cl |
Product Overview
3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol (CAS 187812-06-2), with molecular formula C10H7ClF3NO2 and molecular weight 265.01 g/mol. IUPAC: 3-(4-chlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-5-ol.
Chemical Property Profile of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol
Property Insights of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol
The XLogP value of 2.7153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol. With a topological polar surface area (TPSA) of 41.82 Ų, 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-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-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol?
The CAS number of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol is 187812-06-2.
What is the molecular formula of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol?
The molecular formula of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol is C10H7ClF3NO2.
What is the molecular weight of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol?
The molecular weight of 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol is 265.01 g/mol.
Where can I buy 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol?
You can request a quote for 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.