罗丹明123游离碱
TL;DR: 罗丹明123游离碱 (CAS 104114-27-4) is a chemical compound with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
罗丹明123游离碱
methyl 2-(3-amino-6-iminoxanthen-9-yl)benzoate
Also Known As: Rhodamine 123, Rhodamine 123 free base, Rhodamie methyl, RHODAMINE123, rhodamine 110 methyl ester
| Molecular Formula | C21H16N2O3 |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 85.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.1161 |
| Heavy Atoms | 26 |
| Complexity | 706.0 |
Chemical Identifiers
| CAS Number | 104114-27-4 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1C2=C3C=CC(=N)C=C3OC4=C2C=CC(=C4)N |
| InChIKey | FCGVBHISQBBIQF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
罗丹明123游离碱 (CAS 104114-27-4), with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol. IUPAC: methyl 2-(3-amino-6-iminoxanthen-9-yl)benzoate.
Chemical Property Profile of 罗丹明123游离碱
Property Insights of 罗丹明123游离碱
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 罗丹明123游离碱. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 罗丹明123游离碱. Following Lipinski's Rule of Five, 罗丹明123游离碱 has 2 hydrogen bond donor(s) and 5 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 罗丹明123游离碱?
The CAS number of 罗丹明123游离碱 is 104114-27-4.
What is the molecular formula of 罗丹明123游离碱?
The molecular formula of 罗丹明123游离碱 is C21H16N2O3.
What is the molecular weight of 罗丹明123游离碱?
The molecular weight of 罗丹明123游离碱 is 344.12 g/mol.
Where can I buy 罗丹明123游离碱?
You can request a quote for 罗丹明123游离碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 罗丹明123游离碱?
Yes, KEHONG BIO provides custom synthesis services for 罗丹明123游离碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.