2,5-Diaminotolueno sulfato - ≥98% , CAS No.615-50-9

CAS: 615-50-9 Cat. No.: D121697 Peso molecular: 220.25 Beilstein Registry Number: 3755478 Número EC: 210-431-8

GRADE & PURITY ≥98%

Synonyms

sulfato de 2-metil-p-fenilendiamina | CI Base de oxidación 4 | Sulfato de 2,5-diaminotolueno | Q27270862 | Sulfato de p-tolilendiamina | 8PSD05SPE2 | UNII-8PSD05SPE2 | Sulfato de tolueno-2,5-diamina | Sulfato de 2-metil-1,4-bencenodiamina | 2-metil-p-feni

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Sinónimos

sulfato de 2-metil-p-fenilendiamina | CI Base de oxidación 4 | Sulfato de 2, 5-diaminotolueno | Q27270862 | Sulfato de p-tolilendiamina | 8PSD05SPE2 | UNII-8PSD05SPE2 | Sulfato de tolueno-2, 5-diamina | Sulfato de 2-metil-1, 4-bencenodiamina | 2-metil-p-feni

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

FedEx DG Service

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504753102
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753102
• Sonrisas canónicas: CC1=C(C=CC(=C1)N)N.OS(=O)(=O)O
• IUPAC Name: 2-methylbenzene-1,4-diamine;sulfuric acid
• InChIKey: KZTWOUOZKZQDMN-UHFFFAOYSA-N
• INCHI: 1S/C7H10N2.H2O4S/c1-5-4-6(8)2-3-7(5)9;1-5(2,3)4/h2-4H,8-9H2,1H3;(H2,1,2,3,4)
• Isómeros SMILES: CC1=C(C=CC(=C1)N)N.OS(=O)(=O)O
• WGK Alemania: 3
• RTECS: XT0525000
• Peso molecular: 220.25
• Beilstein: 3755478
• Reaxy-Rn: 3755478
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3755478&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Toluenes
        • Level5 Aminotoluenes
          • Level6 Diaminotoluenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Toluenes
• Intermediate Tree Nodes: Aminotoluenes
• Direct Parent: Diaminotoluenes
• Alternative Parents: Aniline and substituted anilines Organic sulfuric acids Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diaminotoluene - Aniline or substituted anilines - Sulfuric acid - Organic sulfuric acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diaminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group exactly 2 amino groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Slightly soluble in water
• Punto de fusión (°C): >300°C
• Peso molecular: 220.250 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 220.052 Da
• Monoisotopic Mass: 220.052 Da
• Topological Polar Surface Area: 135.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 174.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Wang Chunyan, Huang Gengli, Luo Xueli, Tang Wenzhi, Yue Tianli, Li Zhonghong.  (2022)  Construction of ratiometric fluorescence sensor and test strip with smartphone based on dual-emission carbon dots for the specific detection of chlortetracycline.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  414  (28): (8143-8154).  [PMID:36194240] [10.1007/s00216-022-04349-0]

2. Xiaoping Yue, Feiyang Xu, Linrong Zhang, Guozhang Ren, Huixiang Sheng, Jin Wang, Kaili Wang, Liuyingzi Yu, Junjie Wang, Gongqiang Li, Gang Lu, Hai-Dong Yu.  (2022)  Simple, Skin-Attachable, and Multifunctional Colorimetric Sweat Sensor.  ACS Sensors,      [PMID:35903889] [10.1021/acssensors.2c00581]

3. Shuai Li, Tianxiang Yang, Wenlian Wang, Jing Lu, Xiaoyang Zhao, Weizhen Fan, Xiaoxi Zuo, Junmin Nan.  (2020)  2-Thiophene sulfonamide (2-TS)-contained multi-functional electrolyte matching high-voltage LiNi0.8Mn0.1Co0.1O2/graphite batteries with enhanced performances.  ELECTROCHIMICA ACTA,      [PMID:] [10.1016/j.electacta.2020.136492]

4. Ying Liu, Jiming Chen, Yaoheng Zhang, Sheng Gao, Zaijun Lu, Qingbin Xue.  (2017)  Highly thermal conductive benzoxazine-epoxy interpenetrating polymer networks containing liquid crystalline structures.  JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS,  55  (24): (1813-1821).  [PMID:] [10.1002/polb.24414]

5. Shan Huang, Pingping Mu, Guixin Li, Wei Ni, Yi Fang, Fuxiang Wei, Qi Xiao.  (2025)  Highly sensitive red-emitting carbon dot-based fluorescence sensor for simultaneous detection of copper ions and L-histidine in environmental and biomedical samples.  JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY,      [PMID:] [10.1016/j.jphotochem.2025.116588]