Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-
TL;DR: Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- (CAS 50891-76-4) is a chemical compound with molecular formula C16H17Cl2NO and molecular weight 309.06873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-bis(2-chloroethyl)-4-phenoxyaniline
Also Known As: NCIOpen2_007845, n,n-bis(2-chloroethyl)-4-phenoxyaniline, Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-, Aniline, N,N-bis(2-chloroethyl)-p-phenoxy-, N,N-Bis(2-chloroethyl)-4-phenoxybenzenamine
Technical Specifications
| Molecular Formula | C16H17Cl2NO |
| Molecular Weight | 309.06873 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 309.06873 Da |
| Heavy Atoms | 20 |
| Complexity | 245.0 |
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | JJOMUOBVZPKILJ-UHFFFAOYSA-N |
Chemical Property Profile of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-
Property Insights of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-
The XLogP value of 4.4 indicates that Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-?
The CAS number of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- is 50891-76-4.
What is the molecular formula of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-?
The molecular formula of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- is C16H17Cl2NO.
What is the molecular weight of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-?
The molecular weight of Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- is 309.06873 g/mol.
Where can I buy Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-?
You can request a quote for Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy-?
Yes, CoreyChem provides custom synthesis services for Benzenamine, N,N-bis(2-chloroethyl)-4-phenoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.