Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate
TL;DR: Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate (CAS 22953-55-5) is a chemical compound with molecular formula C17H16Cl2FNO2 and molecular weight 355.0542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[bis(2-chloroethyl)amino]phenyl] 3-fluorobenzoate
Also Known As: [4-[bis(2-chloroethyl)amino]phenyl] 3-fluorobenzoate|[4-[bis amino]phenyl]3-fluorobenzoate|p-(Bis(2-chloroethyl)amino)phenol m-fluorobenzoate|p-(Bis(2-chloroethyl)amino)phenyl m-fluorobenzoate|4-[bis(2-chloroethyl)amino]phenyl 3-fluorobenzoate|Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate|Benzoic acid, m-fluoro-, p-(bis(2-chloroethyl)amino)phenyl ester|p-[Bis(2-chloroethyl)amino]phenyl=m-fluorobenzoate|3-Chlor-benzoesaeure-4-[N,N-bis-(2-chlorethyl)-amino]-phenylester|Benzoic acid, 3-fluoro-, 4-[bis(2-chloroethyl)amino]phenyl ester|Benzoic acid, m-fluoro-, p-[bis(2-chloroethyl)amino]phenyl ester|BRN 2767666|CHEMBL3246951
Technical Specifications
| Molecular Formula | C17H16Cl2FNO2 |
| Molecular Weight | 355.0542 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.0542 Da |
| Heavy Atoms | 23 |
| Complexity | 359.0 |
| SMILES | C1=CC(=CC(=C1)F)C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | WNHQFWFQAJPQMC-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate
Property Insights of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate
The XLogP value of 4.7 indicates that Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate?
The CAS number of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate is 22953-55-5.
What is the molecular formula of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate?
The molecular formula of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate is C17H16Cl2FNO2.
What is the molecular weight of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate?
The molecular weight of Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate is 355.0542 g/mol.
Where can I buy Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate?
You can request a quote for Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate?
Yes, CoreyChem provides custom synthesis services for Phenol, p-(bis(2-chloroethyl)amino)-, m-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.