5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol
TL;DR: 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol (CAS 339322-22-4) is a chemical compound with molecular formula C10H9F2NO3 and molecular weight 229.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(difluoromethyl)-3-(2-hydroxyphenyl)-4H-1,2-oxazol-5-ol
Also Known As: 5-(difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol, 5-(difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydroisoxazol-5-ol, 5-(difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-1,2-oxazol-5-ol, (6E)-6-[5-(difluoromethyl)-5-hydroxy-1,2-oxazolidin-3-ylidene]cyclohexa-2,4-dien-1-one, (6Z)-6-[5-(difluoromethyl)-5-hydroxy-1,2-oxazolidin-3-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C10H9F2NO3 |
|---|---|
| Molecular Weight | 229.06 g/mol |
| LogP | 1.4703 |
| Topological Polar Surface Area | 62.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.05505 |
| Heavy Atoms | 16 |
| Complexity | 435.82724 |
Chemical Identifiers
| CAS Number | 339322-22-4 |
|---|---|
| SMILES | C1C(=NOC1(C(F)F)O)C2=CC=CC=C2O |
Product Overview
5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol (CAS 339322-22-4), with molecular formula C10H9F2NO3 and molecular weight 229.06 g/mol. IUPAC: 5-(difluoromethyl)-3-(2-hydroxyphenyl)-4H-1,2-oxazol-5-ol.
Chemical Property Profile of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol
Property Insights of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol
The XLogP value of 1.4703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol. The TPSA of 62.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol. Following Lipinski's Rule of Five, 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol has 2 hydrogen bond donor(s) and 4 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 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol?
The CAS number of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol is 339322-22-4.
What is the molecular formula of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol?
The molecular formula of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol is C10H9F2NO3.
What is the molecular weight of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol?
The molecular weight of 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol is 229.06 g/mol.
Where can I buy 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol?
You can request a quote for 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol?
Yes, KEHONG BIO provides custom synthesis services for 5-(Difluoromethyl)-3-(2-hydroxyphenyl)-4,5-dihydro-5-isoxazolol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.