Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate
C28H22N3NaO7S2
sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate
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Identification
- CAS Number
- 84057-97-6
- EC Number
- 400-100-8
- UN Number
- 3077
- Index Number
- 016-065-00-3
- PubChem CID
- 44144785
Physical-chemical properties
- Molecular Formula
- C28H22N3NaO7S2
- Molar Mass
- 599.60 g/mol
- IUPAC Name
- sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate
Chemical Identifiers
- InChI
- InChI=1S/C28H23N3O7S2.Na/c1-15-7-11-18(12-8-15)39(34,35)31-17-10-9-16(2)21(13-17)30-22-14-23(40(36,37)38)26(29)25-24(22)27(32)19-5-3-4-6-20(19)28(25)33;/h3-14,30-31H,29H2,1-2H3,(H,36,37,38);/q;+1/p-1
- InChI Key
- HUVRATWEFXEASA-UHFFFAOYSA-M
Overview
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate (CAS 84057-97-6) is an anthracene-based sulfonated dye compound with distinctive chromophoric properties and aquatic toxicity classification. This complex organic sodium salt belongs to the family of anthraquinone derivatives, characterized by its distinctive anthracene backbone structure combined with amino and sulfonamide functional groups. With a molecular formula of C28H22N3NaO7S2 and molecular weight of 599.6 g/mol, this compound represents a sophisticated example of synthetic organic chemistry applied to industrial colorant technology. The molecule features multiple aromatic rings, sulfonyl linkages, and amino substituents that contribute to its unique chemical and physical properties. From a safety perspective, this substance is classified under GHS pictogram GHS09 with Aquatic Chronic 2 hazard classification, indicating potential long-term environmental effects on aquatic life. The ADR Class 9 classification designates it as a miscellaneous dangerous good for transport purposes, though it carries no specific signal word under current regulations. This environmental classification is particularly relevant when considering structurally related compounds such as 4-[9-(4-amino-3-chlorophenyl)fluoren-9-yl]-2-chloroaniline, which shares similar aromatic amine characteristics. Primary industrial applications include specialized dyeing processes, colorant formulations for technical textiles, and as an intermediate in the synthesis of advanced organic pigments. The compound's sulfonated structure provides enhanced water solubility, making it particularly valuable in aqueous-based industrial processes where conventional organic dyes may exhibit limited solubility. OYSI maintains reliable supply chains for this specialized anthracene derivative, ensuring consistent availability for European industrial customers requiring high-quality technical grade materials.
Safety & Classification
Aquatic Chronic 2
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Toxic to aquatic life with long lasting effects.
Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).
First Aid Measures
Transport (ADR)
| UN Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | Natrium-1-amino-4-[2-methyl-5-(4-methylphenylsulfonylamino)-phenylamino]anthrachinon-2-sulfonat |
| Marine Pollutant | No |
Frequently Asked Questions
What is sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is a complex organic sodium salt compound with the molecular formula C28H22N3NaO7S2. This anthraquinone derivative has a molecular weight of 599.6 g/mol and is identified by CAS number 84057-97-6. The compound features an anthracene backbone with multiple functional groups including amino, sulfonate, and sulfonamide moieties, making it suitable for specialized industrial applications requiring specific chemical properties.
What are the physicochemical properties of sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is a solid compound at room temperature with a molecular weight of 599.6 g/mol. As a sodium sulfonate salt, it typically exhibits good water solubility due to its ionic nature. The compound contains multiple aromatic rings and conjugated systems, which typically impart color properties. The presence of sulfonate groups enhances its stability in aqueous solutions and contributes to its chemical reactivity profile.
What is sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate used for?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is primarily used in specialized industrial applications. Given its complex anthraquinone structure with amino and sulfonate functional groups, it is typically employed in chemical synthesis processes, potentially as an intermediate compound or specialty reagent. The compound may also find applications in analytical chemistry, research and development, or as a component in specialized formulations requiring its unique chemical properties and structural characteristics.
How to handle sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate safely?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate should be handled with standard chemical safety precautions. Wear appropriate personal protective equipment including safety glasses, gloves, and protective clothing. Work in well-ventilated areas to avoid dust inhalation. Although no specific GHS signal word is assigned, the compound requires careful handling due to its Aquatic Chronic 2 classification. Avoid release to the environment and follow good laboratory practices including proper hygiene measures and avoiding contact with skin and eyes.
How to store sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate correctly?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate should be stored in a cool, dry place away from direct sunlight and moisture. Keep the compound in its original, tightly sealed container to prevent contamination and degradation. Store away from incompatible materials and ensure adequate ventilation in storage areas. Given its environmental hazard classification (Aquatic Chronic 2), take special precautions to prevent accidental release to water systems and maintain appropriate containment measures.
What to do in case of contact with sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate?
In case of skin contact with sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate, immediately wash the affected area with plenty of soap and water. For eye contact, rinse thoroughly with clean water for at least 15 minutes and seek medical attention. If inhaled, move to fresh air immediately. In case of ingestion, do not induce vomiting and seek immediate medical attention. Remove contaminated clothing and wash before reuse. Always consult the safety data sheet for complete emergency procedures.
How to dispose of sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate appropriately?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate must be disposed of through authorized waste management companies specializing in chemical waste. Due to its Aquatic Chronic 2 classification, prevent release to sewage systems, waterways, or soil. The compound should be treated as hazardous waste and disposed of according to local and national environmental regulations. Contact licensed waste disposal contractors and provide them with the safety data sheet to ensure proper handling and disposal methods are employed.
How to transport sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is classified as ADR Class 9 (Miscellaneous dangerous goods), Packing Group III. This classification requires appropriate packaging, labeling, and documentation for transport. Use UN-approved packaging suitable for Class 9 materials and ensure proper hazard placarding on transport vehicles. The shipment must be accompanied by appropriate transport documents and handled by trained personnel familiar with dangerous goods regulations. Follow ADR requirements for loading, segregation, and emergency procedures during transport.
Is sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate subject to specific regulations?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is subject to REACH registration requirements in Europe and CLP classification as Aquatic Chronic 2 with GHS09 pictogram. The compound is not listed as a Substance of Very High Concern (SVHC). Users must comply with environmental protection regulations due to its aquatic toxicity classification. Companies handling this substance must ensure proper risk assessments, safety data sheet provision, and compliance with occupational health and safety regulations in their respective jurisdictions.
Where to buy sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate in Europe?
Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound to industrial customers across Europe with proper documentation, safety data sheets, and regulatory compliance support. As a technical specialty chemical, availability may be subject to minimum order quantities and lead times. Contact OYSI directly for current availability, specifications, and pricing information for your specific application requirements.
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Sodium 1-amino-4-[2-methyl-5-[(4-methylphenyl)sulfonylamino]anilino]-9,10-dioxoanthracene-2-sulfonate is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.