酸性红94
TL;DR: 酸性红94 (CAS 4159-77-7) is a chemical compound with molecular formula C20H4Cl4I4O5 and molecular weight 971.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酸性红94
4,5,6,7-tetrachloro-3',6'-dihydroxy-2',4',5',7'-tetraiodospiro[2-benzofuran-3,9'-xanthene]-1-one
Also Known As: Rose Bengal lactone, Solvent Red 141, Rose bengal B, Bengal Rose B, C.I. Solvent Red 141
| Molecular Formula | C20H4Cl4I4O5 |
|---|---|
| Molecular Weight | 971.50 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 973.4962 |
| Heavy Atoms | 33 |
| Complexity | 780.0 |
Chemical Identifiers
| CAS Number | 4159-77-7 |
|---|---|
| SMILES | C1=C2C(=C(C(=C1I)O)I)OC3=C(C(=C(C=C3C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)I)O)I |
| InChIKey | IICCLYANAQEHCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
酸性红94 (CAS 4159-77-7), with molecular formula C20H4Cl4I4O5 and molecular weight 971.50 g/mol. IUPAC: 4,5,6,7-tetrachloro-3',6'-dihydroxy-2',4',5',7'-tetraiodospiro[2-benzofuran-3,9'-xanthene]-1-one.
Chemical Property Profile of 酸性红94
Property Insights of 酸性红94
The XLogP value of 8.5 indicates that 酸性红94 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 酸性红94. Following Lipinski's Rule of Five, 酸性红94 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 酸性红94?
The CAS number of 酸性红94 is 4159-77-7.
What is the molecular formula of 酸性红94?
The molecular formula of 酸性红94 is C20H4Cl4I4O5.
What is the molecular weight of 酸性红94?
The molecular weight of 酸性红94 is 971.50 g/mol.
Where can I buy 酸性红94?
You can request a quote for 酸性红94 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酸性红94?
Yes, KEHONG BIO provides custom synthesis services for 酸性红94 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.