Fluorescein Methyl ester
TL;DR: Fluorescein Methyl ester (CAS 70672-06-9) is a chemical compound with molecular formula C21H14O5 and molecular weight 346.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3-hydroxy-6-oxoxanthen-9-yl)benzoate
Also Known As: Fluorescein Methyl ester, Flfluorescin methyl, methyl 2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoate, methyl 2-(3-hydroxy-6-oxoxanthen-9-yl)benzoate, Benzoic acid, 2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-, methyl ester
| Molecular Formula | C21H14O5 |
|---|---|
| Molecular Weight | 346.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.08414 |
| Heavy Atoms | 26 |
| Complexity | 701.0 |
Chemical Identifiers
| CAS Number | 70672-06-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O |
| InChIKey | IWMKLWJDGZMNGT-UHFFFAOYSA-N |
Product Overview
Fluorescein Methyl ester (CAS 70672-06-9), with molecular formula C21H14O5 and molecular weight 346.08 g/mol. IUPAC: methyl 2-(3-hydroxy-6-oxoxanthen-9-yl)benzoate.
Chemical Property Profile of Fluorescein Methyl ester
Property Insights of Fluorescein Methyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fluorescein Methyl ester. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluorescein Methyl ester. Following Lipinski's Rule of Five, Fluorescein Methyl ester has 1 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 Fluorescein Methyl ester?
The CAS number of Fluorescein Methyl ester is 70672-06-9.
What is the molecular formula of Fluorescein Methyl ester?
The molecular formula of Fluorescein Methyl ester is C21H14O5.
What is the molecular weight of Fluorescein Methyl ester?
The molecular weight of Fluorescein Methyl ester is 346.08 g/mol.
Where can I buy Fluorescein Methyl ester?
You can request a quote for Fluorescein Methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluorescein Methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Fluorescein Methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.