Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-
TL;DR: Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- (CAS 65406-08-8) is a chemical compound with molecular formula C14H21Cl2N and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-N,N-bis(2-chloroethyl)aniline
Also Known As: 4-butyl-N,N-bis(2-chloroethyl)aniline, N(CCCl)(CCCl)c1ccc(CCCC)cc1, Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-, 4-Butyl-N,N-bis(2-chloroethyl)benzeneamine, RefChem:324350
| Molecular Formula | C14H21Cl2N |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 273.1051 |
| Heavy Atoms | 17 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 65406-08-8 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)N(CCCl)CCCl |
| InChIKey | BKAPJEGNJWLJEM-UHFFFAOYSA-N |
Product Overview
Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- (CAS 65406-08-8), with molecular formula C14H21Cl2N and molecular weight 273.11 g/mol. IUPAC: 4-butyl-N,N-bis(2-chloroethyl)aniline.
Chemical Property Profile of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-
Property Insights of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-
The XLogP value of 3.5 indicates that Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- has 0 hydrogen bond donor(s) and 1 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 Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-?
The CAS number of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- is 65406-08-8.
What is the molecular formula of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-?
The molecular formula of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- is C14H21Cl2N.
What is the molecular weight of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-?
The molecular weight of Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- is 273.11 g/mol.
Where can I buy Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-?
You can request a quote for Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneamine, 4-butyl-N,N-bis(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.