Sulfan Blue
TL;DR: Sulfan Blue (CAS 129-17-9) is a chemical compound with molecular formula C27H31N2NaO6S2 and molecular weight 566.1521 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,3-disulfonate
Also Known As: Patent Blue VF, Sulfan Blue, Acid blue 1, Patent blue violet, Patent Blue
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C27H31N2NaO6S2 |
| Molecular Weight | 566.1521 g/mol |
| XLogP | 0.77 |
| Topological Polar Surface Area (TPSA) | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 566.1521 Da |
| Heavy Atoms | 38 |
| Complexity | 1040.0 |
| Solubility | Soluble (>=10 mg/ml at 70 °F) (NTP, 1992) |
| SMILES | CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+] |
| InChIKey | SJEYSFABYSGQBG-UHFFFAOYSA-M |
Product Description
Applications: Sulfan Blue is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Sulfan Blue (CAS 129-17-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Sulfan Blue (CAS 129-17-9) has the molecular formula C27H31N2NaO6S2 and a molecular weight of 566.15 g/mol. Reported properties include a solubility: Soluble (>=10 mg/ml at 70 °F) (NTP, 1992). It is also known as Patent Blue VF and Sulfan Blue.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Sulfan Blue
Property Insights of Sulfan Blue
The XLogP value of 0.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfan Blue. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfan Blue. Following Lipinski's Rule of Five, Sulfan Blue has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Sulfan Blue?
The CAS number of Sulfan Blue is 129-17-9.
What is the molecular formula of Sulfan Blue?
The molecular formula of Sulfan Blue is C27H31N2NaO6S2.
What is the molecular weight of Sulfan Blue?
The molecular weight of Sulfan Blue is 566.1521 g/mol.
What are the applications of Sulfan Blue?
Sulfan Blue is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Sulfan Blue (CAS 129-17-9) with custom synthesis available from milligram to...
Where can I buy Sulfan Blue?
You can request a quote for Sulfan Blue directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sulfan Blue?
Yes, CoreyChem provides custom synthesis services for Sulfan Blue and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.