N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline
TL;DR: N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline (CAS 64253-12-9) is a chemical compound with molecular formula C17H19Cl2N3 and molecular weight 335.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-3-methyl-4-phenyldiazenylaniline
Also Known As: N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline, 4-(N,N-Di-2''-chloroethylamino)-2-methylazobenzene, N,N-bis(2-chloroethyl)-3-methyl-4-phenyldiazenylaniline, Benzenamine, N,N-bis(2-chloroethyl)-3-methyl-4-(phenylazo)-, 3-Methyl-4-(phenylazo)-N,N-bis(2-chloroethyl)aniline
| Molecular Formula | C17H19Cl2N3 |
|---|---|
| Molecular Weight | 335.10 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 28.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 335.0956 |
| Heavy Atoms | 22 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 64253-12-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)N=NC2=CC=CC=C2 |
| InChIKey | WRDRPCGBZOZRJP-UHFFFAOYSA-N |
Product Overview
N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline (CAS 64253-12-9), with molecular formula C17H19Cl2N3 and molecular weight 335.10 g/mol. IUPAC: N,N-bis(2-chloroethyl)-3-methyl-4-phenyldiazenylaniline.
Chemical Property Profile of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline
Property Insights of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline
The XLogP value of 5.4 indicates that N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.0 Ų, N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline?
The CAS number of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline is 64253-12-9.
What is the molecular formula of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline?
The molecular formula of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline is C17H19Cl2N3.
What is the molecular weight of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline?
The molecular weight of N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline is 335.10 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline?
You can request a quote for N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)-3-methyl-4-(phenyldiazenyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.