3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde
TL;DR: 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde (CAS 680185-90-4) is a chemical compound with molecular formula C14H8F3NO5 and molecular weight 327.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzaldehyde
Also Known As: 3-hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde, 3-hydroxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzaldehyde, 3-Hydroxy-4-(2-nitro-4-trifluoromethyl-phenoxy)-benzaldehyde, 3-Hydroxy-4-(2-nitro-4-(trifluoromethyl)phenoxy)benzaldehyde, 3-hydroxy-4-(2-nitro-4-trifluoromethyl-phenoxy)benzaldehyde
| Molecular Formula | C14H8F3NO5 |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | 3.924 |
| Topological Polar Surface Area | 89.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.03546 |
| Heavy Atoms | 23 |
| Complexity | 773.4934 |
Chemical Identifiers
| CAS Number | 680185-90-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=O)O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde (CAS 680185-90-4), with molecular formula C14H8F3NO5 and molecular weight 327.04 g/mol. IUPAC: 3-hydroxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzaldehyde.
Chemical Property Profile of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde
Property Insights of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde
The XLogP value of 3.924 indicates that 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde. Following Lipinski's Rule of Five, 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde has 1 hydrogen bond donor(s) and 5 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-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde?
The CAS number of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde is 680185-90-4.
What is the molecular formula of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde?
The molecular formula of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde is C14H8F3NO5.
What is the molecular weight of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde?
The molecular weight of 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde is 327.04 g/mol.
Where can I buy 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde?
You can request a quote for 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-4-(2-nitro-4-trifluoromethylphenoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.