Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-
TL;DR: Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- (CAS 36167-84-7) is a chemical compound with molecular formula C11H14Cl3N and molecular weight 265.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-chloroethyl)-N-[(4-chlorophenyl)methyl]ethanamine
Also Known As: p-Chloro-dcba, p-Chloro-di-(2-chloroethyl)-benzylamine, N,N-Bis(2-chloroethyl)-4-chlorobenzylamine, N,N-Bis(2-chloroethyl)-p-chlorobenzylamine, (4-chlorobenzyl)bis(2-chloroethyl)amine
| Molecular Formula | C11H14Cl3N |
|---|---|
| Molecular Weight | 265.02 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.0192 |
| Heavy Atoms | 15 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 36167-84-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CN(CCCl)CCCl)Cl |
| InChIKey | RAPBJFPMEMZYHV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- (CAS 36167-84-7), with molecular formula C11H14Cl3N and molecular weight 265.02 g/mol. IUPAC: 2-chloro-N-(2-chloroethyl)-N-[(4-chlorophenyl)methyl]ethanamine.
Chemical Property Profile of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-
Property Insights of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-
The XLogP value of 3.6 indicates that Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- 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 Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-?
The CAS number of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- is 36167-84-7.
What is the molecular formula of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-?
The molecular formula of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- is C11H14Cl3N.
What is the molecular weight of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-?
The molecular weight of Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- is 265.02 g/mol.
Where can I buy Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-?
You can request a quote for Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylamine, N,N-bis(2-chloroethyl)-p-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N,N-bis(2-chloroethyl)-p-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.