Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-
TL;DR: Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- (CAS 87048-86-0) is a chemical compound with molecular formula C14H18Cl2O3 and molecular weight 304.0633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2,5-bis(3-chloropropoxy)phenyl]ethanone
Also Known As: 2,5-Bis(3-chloropropoxy)acetophenone, 1-(2,5-Bis(3-chloropropoxy)phenyl)ethanone, ETHANONE, 1-(2,5-BIS(3-CHLOROPROPOXY)PHENYL)-, 1-[2,5-bis(3-chloropropoxy)phenyl]ethanone, 1-[2,5-Bis(3-chloropropoxy)phenyl]ethan-1-one
Technical Specifications
| Molecular Formula | C14H18Cl2O3 |
| Molecular Weight | 304.0633 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 304.0633 Da |
| Heavy Atoms | 19 |
| Complexity | 261.0 |
| SMILES | CC(=O)C1=C(C=CC(=C1)OCCCCl)OCCCCl |
| InChIKey | VVWCZZSZHIVCFE-UHFFFAOYSA-N |
Chemical Property Profile of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-
Property Insights of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-
The XLogP value of 3.4 indicates that Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-?
The CAS number of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- is 87048-86-0.
What is the molecular formula of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-?
The molecular formula of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- is C14H18Cl2O3.
What is the molecular weight of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-?
The molecular weight of Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- is 304.0633 g/mol.
Where can I buy Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-?
You can request a quote for Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)-?
Yes, CoreyChem provides custom synthesis services for Ethanone, 1-(2,5-bis(3-chloropropoxy)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.