RefChem:90772
TL;DR: RefChem:90772 (CAS 1301-21-9) is a chemical compound with molecular formula C20H8Br4Na2O4 and molecular weight 673.6951 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;4-[4,5,6,7-tetrabromo-1-(4-oxidophenyl)-3-oxo-2-benzofuran-1-yl]phenolate
Also Known As: EINECS 215-095-6, 3,3-Bis(p-hydroxyphenyl)isobenzofuran-1(3H)-one, tetrabromo derivative, disodium salt, TETRABROMOPHENOLPHTHALEIN SODIUM SALT, disodium;4-[4,5,6,7-tetrabromo-1-(4-oxidophenyl)-3-oxo-2-benzofuran-1-yl]phenolate, 3,3-bis(p-hydroxyphenyl)isobenzofuran-1(3H)-one,tetrabromo derivative,disodium salt
Technical Specifications
| Molecular Formula | C20H8Br4Na2O4 |
| Molecular Weight | 673.6951 g/mol |
| XLogP | -0.6459 |
| Topological Polar Surface Area (TPSA) | 72.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 673.6951 Da |
| Heavy Atoms | 30 |
| Complexity | 567.0 |
| SMILES | C1=CC(=CC=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC=C(C=C4)[O-])[O-].[Na+].[Na+] |
| InChIKey | PXXMXZXLVKTPPA-UHFFFAOYSA-L |
Chemical Property Profile of RefChem:90772
Property Insights of RefChem:90772
The XLogP value of -0.6459 indicates that RefChem:90772 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:90772. Following Lipinski's Rule of Five, RefChem:90772 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:90772?
The CAS number of RefChem:90772 is 1301-21-9.
What is the molecular formula of RefChem:90772?
The molecular formula of RefChem:90772 is C20H8Br4Na2O4.
What is the molecular weight of RefChem:90772?
The molecular weight of RefChem:90772 is 673.6951 g/mol.
Where can I buy RefChem:90772?
You can request a quote for RefChem:90772 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:90772?
Yes, CoreyChem provides custom synthesis services for RefChem:90772 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.