1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane
TL;DR: 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane (CAS 16139-47-2) is a chemical compound with molecular formula C23H16O11 and molecular weight 468.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3-(2-carboxy-4-oxochromen-7-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid
Also Known As: Disodium cromproxate, 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane, 7-[3-(2-carboxy-4-oxochromen-7-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid, 1,3-bis(2-carboxychromone-7-oxy)-2-hydroxypropane, disodium salt, 7,7'-((2-Hydroxypropane-1,3-diyl)bis(oxy))bis(4-oxo-4H-chromene-2-carboxylic acid)
| Molecular Formula | C23H16O11 |
|---|---|
| Molecular Weight | 468.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 468.06927 |
| Heavy Atoms | 34 |
| Complexity | 835.0 |
Chemical Identifiers
| CAS Number | 16139-47-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1OCC(COC3=CC4=C(C=C3)C(=O)C=C(O4)C(=O)O)O)OC(=CC2=O)C(=O)O |
| InChIKey | QFLQVUAJKXUXOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane (CAS 16139-47-2), with molecular formula C23H16O11 and molecular weight 468.07 g/mol. IUPAC: 7-[3-(2-carboxy-4-oxochromen-7-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid.
Chemical Property Profile of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane
Property Insights of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane. The TPSA of 166.0 Ų indicates high polarity, suggesting 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane?
The CAS number of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane is 16139-47-2.
What is the molecular formula of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane?
The molecular formula of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane is C23H16O11.
What is the molecular weight of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane?
The molecular weight of 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane is 468.07 g/mol.
Where can I buy 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane?
You can request a quote for 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(2-carboxychromone-7-oxy)-2-hydroxypropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.