(4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile
TL;DR: (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile (CAS 81720-94-7) is a chemical compound with molecular formula C14H10Cl2N2 and molecular weight 276.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-2-chlorophenyl)-2-(4-chlorophenyl)acetonitrile
Also Known As: EINECS 279-801-4, (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile, 2-(4-amino-2-chlorophenyl)-2-(4-chlorophenyl)acetonitrile, 4-amino-2-chloro-alpha-(4-chlorophenyl)benzeneacetonitrile
| Molecular Formula | C14H10Cl2N2 |
|---|---|
| Molecular Weight | 276.02 g/mol |
| LogP | 4.23108 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.0221 |
| Heavy Atoms | 18 |
| Complexity | 600.18134 |
Chemical Identifiers
| CAS Number | 81720-94-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)N)Cl)Cl |
Product Overview
(4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile (CAS 81720-94-7), with molecular formula C14H10Cl2N2 and molecular weight 276.02 g/mol. IUPAC: 2-(4-amino-2-chlorophenyl)-2-(4-chlorophenyl)acetonitrile.
Chemical Property Profile of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile
Property Insights of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile
The XLogP value of 4.23108 indicates that (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.81 Ų, (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile has 1 hydrogen bond donor(s) and 2 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 (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile?
The CAS number of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile is 81720-94-7.
What is the molecular formula of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile?
The molecular formula of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile is C14H10Cl2N2.
What is the molecular weight of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile?
The molecular weight of (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile is 276.02 g/mol.
Where can I buy (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile?
You can request a quote for (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (4-Amino-2-chlorophenyl)(4-chlorophenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.