磺基罗丹明B
TL;DR: 磺基罗丹明B (CAS 3520-42-1) is a chemical compound with molecular formula C29H33N2NaO7S2 and molecular weight 608.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磺基罗丹明B
sodium 4-[3-(diethylamino)-6-diethylazaniumylidene-2,7-dimethylxanthen-9-yl]benzene-1,3-disulfonate
Also Known As: Sulforhodamine B, Lissamine Rhodamine, Acid red 52, Acid Leather Red KB, Acid Red 79
| Molecular Formula | C29H33N2NaO7S2 |
|---|---|
| Molecular Weight | 608.16 g/mol |
| LogP | 1.29 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 608.16266 |
| Heavy Atoms | 41 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 3520-42-1 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1C)C(=C3C=C(C(=[N+](CC)CC)C=C3O2)C)C4=C(C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+] |
| InChIKey | XJENLUNLXRJLEZ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
磺基罗丹明B (CAS 3520-42-1), with molecular formula C29H33N2NaO7S2 and molecular weight 608.16 g/mol. IUPAC: sodium 4-[3-(diethylamino)-6-diethylazaniumylidene-2,7-dimethylxanthen-9-yl]benzene-1,3-disulfonate.
Chemical Property Profile of 磺基罗丹明B
Property Insights of 磺基罗丹明B
The XLogP value of 1.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 磺基罗丹明B. The TPSA of 147.0 Ų indicates high polarity, suggesting 磺基罗丹明B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 磺基罗丹明B has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 磺基罗丹明B?
The CAS number of 磺基罗丹明B is 3520-42-1.
What is the molecular formula of 磺基罗丹明B?
The molecular formula of 磺基罗丹明B is C29H33N2NaO7S2.
What is the molecular weight of 磺基罗丹明B?
The molecular weight of 磺基罗丹明B is 608.16 g/mol.
Where can I buy 磺基罗丹明B?
You can request a quote for 磺基罗丹明B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磺基罗丹明B?
Yes, KEHONG BIO provides custom synthesis services for 磺基罗丹明B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.