![3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 structure](/static/products/989/98923-15-0.png)
3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸
TL;DR: 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 (CAS 98923-15-0) 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-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸
3-[4-nitro-2-(trifluoromethyl)phenoxy]benzoic acid
Also Known As: 3-[4-nitro-2-(trifluoromethyl)phenoxy]benzoic acid, 1-diacetoxymethyl-2-methoxy-4-nitro-benzene, Benzoic acid,3-[4-nitro-2-(trifluoromethyl)phenoxy]-, A2206/0092903
| Molecular Formula | C14H8F3NO5 |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.03546 |
| Heavy Atoms | 23 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 98923-15-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(=O)O |
| InChIKey | GZPGTEAZLDBVSZ-UHFFFAOYSA-N |
Product Overview
3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 (CAS 98923-15-0), with molecular formula C14H8F3NO5 and molecular weight 327.04 g/mol. IUPAC: 3-[4-nitro-2-(trifluoromethyl)phenoxy]benzoic acid.
Chemical Property Profile of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸
Property Insights of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸
The XLogP value of 3.7 indicates that 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸. Following Lipinski's Rule of Five, 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 has 1 hydrogen bond donor(s) and 8 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-硝基-2-(三氟甲基)苯氧基]苯甲酸?
The CAS number of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 is 98923-15-0.
What is the molecular formula of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸?
The molecular formula of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 is C14H8F3NO5.
What is the molecular weight of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸?
The molecular weight of 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 is 327.04 g/mol.
Where can I buy 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸?
You can request a quote for 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-硝基-2-(三氟甲基)苯氧基]苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.