4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone
TL;DR: 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone (CAS 155748-61-1) is a chemical compound with molecular formula C16H12Cl2O and molecular weight 290.02652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-one
Also Known As: 4-(3,4-Dichlorophenyl)-1-tetralone, sertralone, Sertraline Tetralone, Rac-tetralone, 4-(3,4-Dichlorophenyl)-3,4-dihydronaphthalen-1(2H)-one
Technical Specifications
| Molecular Formula | C16H12Cl2O |
| Molecular Weight | 290.02652 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.02652 Da |
| Heavy Atoms | 19 |
| Complexity | 344.0 |
| SMILES | C1CC(=O)C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | JGMBHJNMQVKDMW-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone
Property Insights of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone
The XLogP value of 4.7 indicates that 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone 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 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone?
The CAS number of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone is 155748-61-1.
What is the molecular formula of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone?
The molecular formula of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone is C16H12Cl2O.
What is the molecular weight of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone?
The molecular weight of 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone is 290.02652 g/mol.
Where can I buy 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone?
You can request a quote for 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone?
Yes, CoreyChem provides custom synthesis services for 4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.