2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile
TL;DR: 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile (CAS 180263-44-9) is a chemical compound with molecular formula C21H13Cl2NO and molecular weight 365.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile
Also Known As: 2-(4-benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile, Bionet1_001642, 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl) acetonitrile, 6K-089, 3-Amino-3-[4-(trifluoromethyl)-phenyl]propanoic acid
| Molecular Formula | C21H13Cl2NO |
|---|---|
| Molecular Weight | 365.04 g/mol |
| LogP | 5.87988 |
| Topological Polar Surface Area | 40.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.0374 |
| Heavy Atoms | 25 |
| Complexity | 943.8801 |
Chemical Identifiers
| CAS Number | 180263-44-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(C#N)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile (CAS 180263-44-9), with molecular formula C21H13Cl2NO and molecular weight 365.04 g/mol. IUPAC: 2-(4-benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile.
Chemical Property Profile of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile
Property Insights of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile
The XLogP value of 5.87988 indicates that 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.86 Ų, 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile has 0 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 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile?
The CAS number of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile is 180263-44-9.
What is the molecular formula of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile?
The molecular formula of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile is C21H13Cl2NO.
What is the molecular weight of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile?
The molecular weight of 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile is 365.04 g/mol.
Where can I buy 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile?
You can request a quote for 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Benzoylphenyl)-2-(2,4-dichlorophenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.