3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide
TL;DR: 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide (CAS 646989-56-2) is a chemical compound with molecular formula C14H7Cl3F6N2O2 and molecular weight 453.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-amino-3-[3,5-bis(trifluoromethyl)phenyl]prop-2-enylidene]amino] 2,3,3-trichloroprop-2-enoate
Also Known As: 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide, O1-(2,3,3-trichloroacryloyl)-3-[3,5-di(trifluoromethyl)phenyl]prop-2-enehydroximamide, [[1-amino-3-[3,5-bis(trifluoromethyl)phenyl]prop-2-enylidene]amino] 2,3,3-trichloroprop-2-enoate
| Molecular Formula | C14H7Cl3F6N2O2 |
|---|---|
| Molecular Weight | 453.95 g/mol |
| LogP | 5.4383 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 453.94772 |
| Heavy Atoms | 27 |
| Complexity | 779.80115 |
Chemical Identifiers
| CAS Number | 646989-56-2 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=CC(=NOC(=O)C(=C(Cl)Cl)Cl)N |
Product Overview
3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide (CAS 646989-56-2), with molecular formula C14H7Cl3F6N2O2 and molecular weight 453.95 g/mol. IUPAC: [[1-amino-3-[3,5-bis(trifluoromethyl)phenyl]prop-2-enylidene]amino] 2,3,3-trichloroprop-2-enoate.
Chemical Property Profile of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide
Property Insights of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide
The XLogP value of 5.4383 indicates that 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide. Following Lipinski's Rule of Five, 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide 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-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide?
The CAS number of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide is 646989-56-2.
What is the molecular formula of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide?
The molecular formula of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide is C14H7Cl3F6N2O2.
What is the molecular weight of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide?
The molecular weight of 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide is 453.95 g/mol.
Where can I buy 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide?
You can request a quote for 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-Bis(trifluoromethyl)phenyl)-N-((2,3,3-trichloroacryloyl)oxy)acrylimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.