Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate
TL;DR: Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate (CAS 14628-81-0) is a chemical compound with molecular formula C13H6Cl4N2O4 and molecular weight 393.90817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4,6-trichloro-2-nitrophenyl) N-(4-chlorophenyl)carbamate
Also Known As: Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate, 2-Nitro-3,4,6-trichlorophenol p-chlorocarbanilate, 3,4,6-Trichloro-2-nitrophenyl-p-chlorocarbanilate, (3,4,6-trichloro-2-nitrophenyl) N-(4-chlorophenyl)carbamate, Phenol,4,6-trichloro-, p-chlorocarbanilate
Technical Specifications
| Molecular Formula | C13H6Cl4N2O4 |
| Molecular Weight | 393.90817 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.9052 Da |
| Heavy Atoms | 23 |
| Complexity | 442.0 |
| SMILES | C1=CC(=CC=C1NC(=O)OC2=C(C(=C(C=C2Cl)Cl)Cl)[N+](=O)[O-])Cl |
| InChIKey | XEYNDINQFLTEIQ-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate
Property Insights of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate
The XLogP value of 5.4 indicates that Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate. Following Lipinski's Rule of Five, Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate?
The CAS number of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate is 14628-81-0.
What is the molecular formula of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate?
The molecular formula of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate is C13H6Cl4N2O4.
What is the molecular weight of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate?
The molecular weight of Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate is 393.90817 g/mol.
Where can I buy Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate?
You can request a quote for Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate?
Yes, CoreyChem provides custom synthesis services for Phenol, 2-nitro-3,4,6-trichloro-, p-chlorocarbanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.