((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile
TL;DR: ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile (CAS 74929-43-4) is a chemical compound with molecular formula C14H9Cl3N2 and molecular weight 309.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile
Also Known As: [ amino] acetonitrile|EINECS 278-030-0|((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile|2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile|(4-Chloroanilino)(2,6-dichlorophenyl)acetonitrile|[(4-Chlorophenyl)amino](2,6-dichlorophenyl)acetonitrile|2,6-dichloro-alpha-[(4-chlorophenyl)amino]benzeneacetonitrile|2-[(4-CHLOROPHENYL)AMINO]-2-(2,6-DICHLOROPHENYL)ACETONITRILE
| Molecular Formula | C14H9Cl3N2 |
|---|---|
| Molecular Weight | 309.98 g/mol |
| LogP | 5.32358 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.98312 |
| Heavy Atoms | 19 |
| Complexity | 597.3285 |
Chemical Identifiers
| CAS Number | 74929-43-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C(C#N)NC2=CC=C(C=C2)Cl)Cl |
Product Overview
((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile (CAS 74929-43-4), with molecular formula C14H9Cl3N2 and molecular weight 309.98 g/mol. IUPAC: 2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile.
Chemical Property Profile of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile
Property Insights of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile
The XLogP value of 5.32358 indicates that ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.82 Ų, ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile?
The CAS number of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile is 74929-43-4.
What is the molecular formula of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile?
The molecular formula of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile is C14H9Cl3N2.
What is the molecular weight of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile?
The molecular weight of ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile is 309.98 g/mol.
Where can I buy ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile?
You can request a quote for ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for ((4-Chlorophenyl)amino)(2,6-dichlorophenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.