Profluralin
TL;DR: Profluralin (CAS 26399-36-0) is a chemical compound with molecular formula C14H16F3N3O4 and molecular weight 347.10928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)aniline
Also Known As: PROFLURALIN, Pregard, Tolban, Profluraline, Caswell No. 271BB
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H16F3N3O4 |
| Molecular Weight | 347.10928 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.10928 Da |
| Heavy Atoms | 24 |
| Complexity | 449.0 |
| Melting Point | 32.1 to 32.5 °C |
| Density | 1.38 at 20 °C |
| Vapor Pressure | 0.000069 [mmHg] |
| Solubility | O.1 PPM IN WATER AT 27 °C; GREATER THAN 1 G/G OF ACETONE |
| SMILES | CCCN(CC1CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
| InChIKey | ITVQAKZNYJEWKS-UHFFFAOYSA-N |
Chemical Property Profile of Profluralin
Property Insights of Profluralin
The XLogP value of 5.2 indicates that Profluralin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Profluralin. Following Lipinski's Rule of Five, Profluralin has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Profluralin?
The CAS number of Profluralin is 26399-36-0.
What is the molecular formula of Profluralin?
The molecular formula of Profluralin is C14H16F3N3O4.
What is the molecular weight of Profluralin?
The molecular weight of Profluralin is 347.10928 g/mol.
Where can I buy Profluralin?
You can request a quote for Profluralin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Profluralin?
Yes, CoreyChem provides custom synthesis services for Profluralin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.