1-(4-Chlorophenyl)-1-phenylacetone
TL;DR: 1-(4-Chlorophenyl)-1-phenylacetone (CAS 42413-59-2) is a chemical compound with molecular formula C15H13ClO and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-1-phenylpropan-2-one
Also Known As: 1-(4-Chlorophenyl)-1-phenylacetone, EINECS 255-813-5, 1-(4-chlorophenyl)-1-phenylpropan-2-one, 1-p-Chlorophenyl-1-phenylacetone, 1-(4-Chlorophenyl)-1-phenyl-2-propanone
| Molecular Formula | C15H13ClO |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 4.0609 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.06549 |
| Heavy Atoms | 17 |
| Complexity | 502.20483 |
Chemical Identifiers
| CAS Number | 42413-59-2 |
|---|---|
| SMILES | CC(=O)C(C1=CC=CC=C1)C2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorophenyl)-1-phenylacetone (CAS 42413-59-2), with molecular formula C15H13ClO and molecular weight 244.07 g/mol. IUPAC: 1-(4-chlorophenyl)-1-phenylpropan-2-one.
Chemical Property Profile of 1-(4-Chlorophenyl)-1-phenylacetone
Property Insights of 1-(4-Chlorophenyl)-1-phenylacetone
The XLogP value of 4.0609 indicates that 1-(4-Chlorophenyl)-1-phenylacetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(4-Chlorophenyl)-1-phenylacetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-1-phenylacetone 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 1-(4-Chlorophenyl)-1-phenylacetone?
The CAS number of 1-(4-Chlorophenyl)-1-phenylacetone is 42413-59-2.
What is the molecular formula of 1-(4-Chlorophenyl)-1-phenylacetone?
The molecular formula of 1-(4-Chlorophenyl)-1-phenylacetone is C15H13ClO.
What is the molecular weight of 1-(4-Chlorophenyl)-1-phenylacetone?
The molecular weight of 1-(4-Chlorophenyl)-1-phenylacetone is 244.07 g/mol.
Where can I buy 1-(4-Chlorophenyl)-1-phenylacetone?
You can request a quote for 1-(4-Chlorophenyl)-1-phenylacetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-1-phenylacetone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-1-phenylacetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.