Sodium Methanesulfonate - ≥98%(T) , CAS No.2386-57-4

CAS: 2386-57-4 Cat. No.: S161234 Peso molecular: 118.08 Beilstein Registry Number: 3915210 Número EC: 219-203-2 PubChem CID: 638112

GRADE & PURITY ≥98%(T)

Synonyms

NSC-240394 | SY003606 | AS-12546 | Sodium methanesulfonate, puriss., 98% | SCHEMBL34839 | Methanesulfonic acid, sodium salt | KKVTYAVXTDIPAP-UHFFFAOYSA-M | CH3NaO3S | NSC 240394 | Sodium methanesulfonate | Sodium methanesulphonate | E70319 | sodium mesyla

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

NSC-240394 | SY003606 | AS-12546 | Sodium methanesulfonate, puriss., 98% | SCHEMBL34839 | Methanesulfonic acid, sodium salt | KKVTYAVXTDIPAP-UHFFFAOYSA-M | CH3NaO3S | NSC 240394 | Sodium methanesulfonate | Sodium methanesulphonate | E70319 | sodium mesyla

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Pubchem Sid: 488190873
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488190873
• Sonrisas canónicas: CS(=O)(=O)[O-].[Na+]
• IUPAC Name: sodium;methanesulfonate
• InChIKey: KKVTYAVXTDIPAP-UHFFFAOYSA-M
• INCHI: 1S/CH4O3S.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1
• Isómeros SMILES: CS(=O)(=O)[O-].[Na+]
• WGK Alemania: 3
• PubChem CID: 638112
• Peso molecular: 118.08
• Beilstein: 3915210
• Reaxy-Rn: 3915209

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acids
• Alternative Parents: Sulfonyls Methanesulfonates Alkanesulfonic acids Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Methanesulfonate - Organic alkali metal salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organosulfur compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organosulfonic acids. These are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R is not a hydrogen atom).
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water, alcohol, ether, hexane, benzene, methylcyclopentane, toluene, o-chlorotoluene and ethyl disulfide.
• Sensibilidad: Moisture sensitive
• Peso molecular: 118.090 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 117.97 Da
• Monoisotopic Mass: 117.97 Da
• Topological Polar Surface Area: 65.600 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 96.500
• 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. Jianguang Qi, Yufeng Hu, Weiting Ma, Haiyan Wang, Siqi Jiang, Liuyi Yin, Xianming Zhang, Zhenyu Yang, Yichuan Wang.  (2017)  The reactions that determine the yield and selectivity of 1,3,5-trioxane.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2017.08.101]

2. Yin Liu-Yi, Hu Yu-Feng, Wang Hai-Yan.  (2016)  The remarkable effect of organic salts on 1,3,5-trioxane synthesis.  Petroleum Science,  13  (4): (770-775).  [PMID:] [10.1007/s12182-016-0124-3]

3. Zou Jing, Wang Yongzhen, Yu Xiang, Liu Rulin, Fan Weiqiang, Cheng Jing, Cai Weiyi.  (2024)  Skin-Inspired Zero Carbon Heat-Moisture Management Based on Shape Memory Smart Fabric.  Advanced Fiber Materials,      [PMID:] [10.1007/s42765-024-00496-4]

4. Yuliang Ye, Jiaxiang Wang, Zunxian Yang, Ye Chen, Hui Zhang, Yuting Bai, Xudong Jiang, Benfang Liu, Jiajie Hong, Yue Chen, Zhezhou Fang, Jinzhu Gao, Zheyu Zhou, Runsen Yu, Xuanyao Song, Zhiyu Yuan, Tailiang Guo, Fushan Li, Yongyi Chen, Zhenzhen Weng.  (2025)  Uncovering the Performance Enhancing Mechanism of Methanesulfonate Ligands in Perovskite Quantum Dots for Light-Emitting Devices.  ACS Applied Materials & Interfaces,      [PMID:39772409] [10.1021/acsami.4c16554]

5. Jiaxiang Wang, Zunxian Yang, Ye Chen, Hui Zhang, Yue Chen, Yuting Bai, Xudong Jiang, Benfang Liu, Jiajie Hong, Zhezhou Fang, Jinzhu Gao, Zheyu Zhou, Runsen Yu, Xuanyao Song, Zhiyu Yuan, Tailiang Guo, Fushan Li, Yongyi Chen, Zhenzhen Weng.  (2025)  Sulfonic Acid Ligands Promote Surface Reconstruction of Perovskite Quantum Dots for High-Performance Light-Emitting Diodes.  Advanced Optical Materials,  13  (8): (2402764).  [PMID:] [10.1002/adom.202402764]