2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯
TL;DR: 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 (CAS 91390-34-0) is a chemical compound with molecular formula C9H7Cl3FNO2 and molecular weight 284.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯
(2,4,5-trichlorophenyl) N-(2-fluoroethyl)carbamate
Also Known As: 2,4,5-trichlorophenyl (2-fluoroethyl)carbamate, Carbamic acid, 2,4,5-trichlorophenyl ester, (2,4,5-trichlorophenyl) N-(2-fluoroethyl)carbamate
| Molecular Formula | C9H7Cl3FNO2 |
|---|---|
| Molecular Weight | 284.95 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.95264 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 91390-34-0 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OC(=O)NCCF |
| InChIKey | ZRKKNQDSBHLTIN-UHFFFAOYSA-N |
Product Overview
2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 (CAS 91390-34-0), with molecular formula C9H7Cl3FNO2 and molecular weight 284.95 g/mol. IUPAC: (2,4,5-trichlorophenyl) N-(2-fluoroethyl)carbamate.
Chemical Property Profile of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯
Property Insights of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯
The XLogP value of 3.7 indicates that 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 has 1 hydrogen bond donor(s) and 3 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 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯?
The CAS number of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 is 91390-34-0.
What is the molecular formula of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯?
The molecular formula of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 is C9H7Cl3FNO2.
What is the molecular weight of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯?
The molecular weight of 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 is 284.95 g/mol.
Where can I buy 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯?
You can request a quote for 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,4,5-三氯苯基(2-氟乙基)氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.