TL;DR: Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- (CAS 10072-37-4) is a chemical compound with molecular formula C18H19Cl2N and molecular weight 319.08945 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)aniline
Also Known As: 4-Stilbenamine, N,N-bis(2-chloroethyl)-, n,n-bis(2-chloroethyl)-4-(2-phenylethenyl)aniline, Bis-(2-chloraethyl)(chlormethyl)phosphinoxid, Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)-, N,N-Bis(2-chloroethyl)-4-(2-phenylethenyl)benzenamine
| Molecular Formula | C18H19Cl2N |
| Molecular Weight | 319.08945 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.08945 Da |
| Heavy Atoms | 21 |
| Complexity | 286.0 |
| SMILES | C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | UYWMEHDTIRHWEV-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- is 10072-37-4.
The molecular formula of Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- is C18H19Cl2N.
The molecular weight of Benzenamine, N,N-bis(2-chloroethyl)-4-(2-phenylethenyl)- is 319.08945 g/mol.
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