1,10-Phenanthroline hydrate
TL;DR: 1,10-Phenanthroline hydrate (CAS 5144-89-8) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,10-phenanthroline;hydrate
Also Known As: 1,10-Phenanthroline hydrate, 1,10-Phenanthroline monohydrate, o-Phenanthroline monohydrate, o-phenanthroline, 1,10-phenanthroline
| Molecular Formula | C12H10N2O |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 1.96 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.07932 |
| Heavy Atoms | 15 |
| Complexity | 182.0 |
| Melting Point | 212 to 103.9 °C |
| Solubility | less than 0.1 mg/mL at 70 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 5144-89-8 |
|---|---|
| SMILES | C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.O |
| InChIKey | PPQJCISYYXZCAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,10-Phenanthroline hydrate (CAS 5144-89-8), with molecular formula C12H10N2O and molecular weight 198.08 g/mol. IUPAC: 1,10-phenanthroline;hydrate.
Chemical Property Profile of 1,10-Phenanthroline hydrate
Property Insights of 1,10-Phenanthroline hydrate
The XLogP value of 1.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,10-Phenanthroline hydrate. With a topological polar surface area (TPSA) of 26.8 Ų, 1,10-Phenanthroline hydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,10-Phenanthroline hydrate has 1 hydrogen bond donor(s) and 3 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 1,10-Phenanthroline hydrate?
The CAS number of 1,10-Phenanthroline hydrate is 5144-89-8.
What is the molecular formula of 1,10-Phenanthroline hydrate?
The molecular formula of 1,10-Phenanthroline hydrate is C12H10N2O.
What is the molecular weight of 1,10-Phenanthroline hydrate?
The molecular weight of 1,10-Phenanthroline hydrate is 198.08 g/mol.
Where can I buy 1,10-Phenanthroline hydrate?
You can request a quote for 1,10-Phenanthroline hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,10-Phenanthroline hydrate?
Yes, KEHONG BIO provides custom synthesis services for 1,10-Phenanthroline hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.