
CAS Number1694-09-3
Synonymsviolet5b; violet5bn; violet2; ACID VIOLET; violet6b; Acid Violet 6B; MFCD00054261; violetno.1; woolviolet; EINECS 216-901-9
Molecular FormulaC39H40N3NaO6S2
Molecular Weight733.888
Purity98.00%
Boiling Point100ºC
Melting Point245-250°C
AppearanceSlightly violet color, water-like liquid, odorless
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1694-09-3 |
| Catalog No. | 2A-9027299 |
| Chinese Name | 酸性紫49 |
| Synonyms | violet5b; violet5bn; violet2; ACID VIOLET; violet6b; Acid Violet 6B; MFCD00054261; violetno.1; woolviolet; EINECS 216-901-9 |
| Molecular Formula | C39H40N3NaO6S2 |
| Molecular Weight | 733.888 |
| Purity | 98.00 |
| Boiling Point | 100ºC |
| Melting Point | 245-250°C |
| Appearance | Slightly violet color, water-like liquid, odorless |
| Water Solubility | Water solubility: soluble; soluble in: ethanol |
| Storage Condition | 1. Keep the container sealed and store in a cool, |
| Packaging | III |
| PubChem ID | 87562176 |
| MDL Number | MFCD03938844 |
| SMILES | [Na+].CCN(Cc1cccc(c1)[S]([O-])(=O)=O)c2ccc(cc2)[C+](c3ccc(cc3)N(C)C)c4ccc(cc4)N(CC)Cc5cccc(c5)[S]([O-])(=O)=O |
| InChI | InChI=1S/C39H41N3O6S2.Na/c1-5-41(27-29-9-7-11-37(25-29)49(43,44)45)35-21-15-32(16-22-35)39(31-13-19-34(20-14-31)40(3)4)33-17-23-36(24-18-33)42(6-2)28-30-10-8-12-38(26-30)50(46,47)48;/h7-26H,5-6,27-28H2,1-4H3,(H-,43,44,45,46,47,48);/q;+1/p-1 |
| InChI Key | InChIKey=AXMCIYLNKNGNOT-UHFFFAOYSA-M |
| MSDS | msds/27299_1_1694_09_3.pdf |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: Item 1 Poisons. UN number: 2811 Proper Shipping Name: Toxic Solid, Organic, Not Otherwise Specified Packing grade: III |
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