1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one
TL;DR: 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one (CAS 125709-31-1) is a chemical compound with molecular formula C15H11ClO and molecular weight 242.04984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chlorophenyl)-3-phenylprop-2-en-1-one
Also Known As: Licoarylcoumarin, 1-(3-chlorophenyl)-3-phenylprop-2-en-1-one, 2-Propen-1-one, 1-(3-chlorophenyl)-3-phenyl-, (2E)-1-(3-chlorophenyl)-3-phenylprop-2-en-1-one, 1-(3-chlorophenyl)-3-phenyl-prop-2-en-1-one
Technical Specifications
| Molecular Formula | C15H11ClO |
| Molecular Weight | 242.04984 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.04984 Da |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2=CC(=CC=C2)Cl |
| InChIKey | CTOPNSVRZAUZGA-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one
Property Insights of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one
The XLogP value of 3.7 indicates that 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one 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
What is the CAS number of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one?
The CAS number of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one is 125709-31-1.
What is the molecular formula of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one?
The molecular formula of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one is C15H11ClO.
What is the molecular weight of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one?
The molecular weight of 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one is 242.04984 g/mol.
Where can I buy 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one?
You can request a quote for 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(3-Chlorophenyl)-3-phenylprop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.