![3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one structure](/static/products/6805/680579-63-9.webp)
3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one
TL;DR: 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one (CAS 680579-63-9) is a chemical compound with molecular formula C21H12F6O3 and molecular weight 426.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[3,5-bis(trifluoromethyl)phenyl]furan-2-yl]-1-(2-hydroxyphenyl)prop-2-en-1-one
Also Known As: 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one, 3-[5-[3,5-bis(trifluoromethyl)phenyl]-2-furyl]-1-(2-hydroxyphenyl)prop-2-en-1-one, 3-[5-[3,5-bis(trifluoromethyl)phenyl]furan-2-yl]-1-(2-hydroxyphenyl)prop-2-en-1-one
| Molecular Formula | C21H12F6O3 |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 6.5859 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.06906 |
| Heavy Atoms | 30 |
| Complexity | 1074.1649 |
Chemical Identifiers
| CAS Number | 680579-63-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)C=CC2=CC=C(O2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)O |
Product Overview
3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one (CAS 680579-63-9), with molecular formula C21H12F6O3 and molecular weight 426.07 g/mol. IUPAC: 3-[5-[3,5-bis(trifluoromethyl)phenyl]furan-2-yl]-1-(2-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one
Property Insights of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one
The XLogP value of 6.5859 indicates that 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one?
The CAS number of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one is 680579-63-9.
What is the molecular formula of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one?
The molecular formula of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one is C21H12F6O3.
What is the molecular weight of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one?
The molecular weight of 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one is 426.07 g/mol.
Where can I buy 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one?
You can request a quote for 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-{5-[3,5-di(trifluoromethyl)phenyl]-2-furyl}-1-(2-hydroxyphenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.