![1-Chloro-[4,7]phenanthroline structure](/static/products/120/120092-42-4.webp)
1-Chloro-[4,7]phenanthroline
TL;DR: 1-Chloro-[4,7]phenanthroline (CAS 120092-42-4) is a chemical compound with molecular formula C12H7ClN2 and molecular weight 214.02977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-4,7-phenanthroline
Also Known As: 1-Chloro-[4,7]phenanthroline, 1-chloro-4,7-phenanthroline
Technical Specifications
| Molecular Formula | C12H7ClN2 |
| Molecular Weight | 214.02977 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.02977 Da |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
| SMILES | C1=CC2=C(C=CC3=NC=CC(=C23)Cl)N=C1 |
| InChIKey | YWRLMNOEPBVGBU-UHFFFAOYSA-N |
Chemical Property Profile of 1-Chloro-[4,7]phenanthroline
Property Insights of 1-Chloro-[4,7]phenanthroline
The XLogP value of 3.1 indicates that 1-Chloro-[4,7]phenanthroline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.8 Ų, 1-Chloro-[4,7]phenanthroline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-[4,7]phenanthroline has 0 hydrogen bond donor(s) and 2 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-Chloro-[4,7]phenanthroline?
The CAS number of 1-Chloro-[4,7]phenanthroline is 120092-42-4.
What is the molecular formula of 1-Chloro-[4,7]phenanthroline?
The molecular formula of 1-Chloro-[4,7]phenanthroline is C12H7ClN2.
What is the molecular weight of 1-Chloro-[4,7]phenanthroline?
The molecular weight of 1-Chloro-[4,7]phenanthroline is 214.02977 g/mol.
Where can I buy 1-Chloro-[4,7]phenanthroline?
You can request a quote for 1-Chloro-[4,7]phenanthroline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloro-[4,7]phenanthroline?
Yes, CoreyChem provides custom synthesis services for 1-Chloro-[4,7]phenanthroline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.