Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
TL;DR: Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate (CAS 256348-27-3) is a chemical compound with molecular formula C18H11F3O2S and molecular weight 348.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
Also Known As: phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate, Maybridge4_004115, IDI1_032937, BRD-K35755464-001-01-0, phenyl4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
| Molecular Formula | C18H11F3O2S |
|---|---|
| Molecular Weight | 348.04 g/mol |
| LogP | 5.6531 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.04318 |
| Heavy Atoms | 24 |
| Complexity | 839.7054 |
Chemical Identifiers
| CAS Number | 256348-27-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(SC(=C2)C(=O)OC3=CC=CC=C3)C(F)(F)F |
Product Overview
Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate (CAS 256348-27-3), with molecular formula C18H11F3O2S and molecular weight 348.04 g/mol. IUPAC: phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate.
Chemical Property Profile of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
Property Insights of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
The XLogP value of 5.6531 indicates that Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate has 0 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 Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate?
The CAS number of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate is 256348-27-3.
What is the molecular formula of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate?
The molecular formula of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate is C18H11F3O2S.
What is the molecular weight of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate?
The molecular weight of Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate is 348.04 g/mol.
Where can I buy Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate?
You can request a quote for Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.