5-Sulfosalicylic acid dihydrate - AR, ≥99% , CAS No.5965-83-3

CAS: 5965-83-3 Cat. No.: S112086 Peso molecular: 254.21 Beilstein Registry Number: 650741 Número EC: 641-618-6 PubChem CID: 2723734

GRADE & PURITY AR, ≥99%

Synonyms

SULFOSALICYLIC ACID DIHYDRATE [MI] | Salicylic acid, 5-sulfo-, dihydrate | 2-Hydroxy-5-sulfobenzoic-acid | Salicylic acid, 5-sulfo-, dihydrate; 5-Sulfosalicylic acid dihydrate | 5-Sulfosalicylic acid dihydrate, ReagentPlus(R), >=99% | FT-0620778 | SALICYL

Storage

Protected from light,Room temperature,Desiccated

Shipped In

Normal

Descripción general

Application Spray reagent for the detection of amino acids on TLC plates. Doping agent for polyaniline. 5-Sulfosalicylic acid dihydrate is a poly functional metal chelating ligand that may be used to form metal coordination complexes.

Specifications

Sinónimos

SULFOSALICYLIC ACID DIHYDRATE [MI] | Salicylic acid, 5-sulfo-, dihydrate | 2-Hydroxy-5-sulfobenzoic-acid | Salicylic acid, 5-sulfo-, dihydrate; 5-Sulfosalicylic acid dihydrate | 5-Sulfosalicylic acid dihydrate, ReagentPlus(R), >=99% | FT-0620778 | SALICYL

Especificaciones y pureza

AR, ≥99%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Desiccated

Enviado en

Normal

Grado

AR

Pureza

≥99%

Nombres e identificadores

• Sonrisas canónicas: C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
• IUPAC Name: 2-hydroxy-5-sulfobenzoic acid;dihydrate
• InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
• INCHI: 1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
• Isómeros SMILES: C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
• WGK Alemania: 3
• CAS alternativo: 97-05-2
• PubChem CID: 2723734
• Peso molecular: 254.21
• Beilstein: 650741

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzenesulfonic acids and derivatives
        • Level5 Sulfobenzoic acids
          • Level6 3-sulfobenzoic acids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzenesulfonic acids and derivatives
• Intermediate Tree Nodes: Sulfobenzoic acids
• Direct Parent: 3-sulfobenzoic acids
• Alternative Parents: Sulfosalicylic acids and derivatives Salicylic acids Benzoic acids Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Sulfonyls Organosulfonic acids Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 3-sulfobenzoic acid - Sulfosalicylic acid or derivatives - Hydroxybenzoic acid - Salicylic acid or derivatives - Salicylic acid - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid or derivatives - Benzoic acid - Arylsulfonic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Vinylogous acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 3-sulfobenzoic acids. These are sulfobenzoic acid carrying the sulfonyl group at the 3-position of the benzene group.
• 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: Soluble in water (127.1 mg/ml at 20 °C), alcohol (very), ether, and polar solvents (generally)
• Sensibilidad: Light Sensitive
• Punto de fusión (°C): 106 - 110 °C
• Peso molecular: 254.220 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 254.01 Da
• Monoisotopic Mass: 254.01 Da
• Topological Polar Surface Area: 122.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 316.000
• 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: 3

XLogP3

Referencias

1. Jinyu Li, Yunjiao Ma, Feng Xiao, Baoshang Fu, Xianbing Xu.  (2023)  Formation and conversion of flavour related compounds of thermal cooked Ruditapes philippinarum soup.  INTERNATIONAL JOURNAL OF FOOD SCIENCE AND TECHNOLOGY,  58  (12): (6421-6431).  [PMID:] [10.1111/ijfs.16753]

2. Xiao Youmei, Xu Zhanxue, Cheng Yuan, Huang Rufan, Xie Yuan, Tsai Hsiang-i, Zha Hualian, Xi Lifang, Wang Kai, Cheng Xiaoli, Gao Yanfeng, Zhang Changhua, Cheng Fang, Chen Hongbo.  (2023)  Fe3+-binding transferrin nanovesicles encapsulating sorafenib induce ferroptosis in hepatocellular carcinoma.  Biomaterials Research,  27  (1): (1-17).  [PMID:37391845] [10.1186/s40824-023-00401-x]

3. Yongqing Liang, Jian Li, Yanjun Zhao.  (2023)  Poly(sulfosalicylic acid)/multi-walled Carbon Nanotube Modified Electrode for the Electrochemical Detection of Catechol.  International Journal of Electrochemical Science,      [PMID:] [10.20964/2017.10.20]

4. Shanghao Wu, Jinke Wang, Tong Liu, Xin Guo, Lingwei Ma.  (2023)  Sulfosalicylic acid modified carbon dots as effective corrosion inhibitor and fluorescent corrosion indicator for carbon steel in HCl solution.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2023.130951]

5. Zhen Zhang, Shancai Guo, Chuanding Chen, Jianyuan Lin, Leyuan Chen, Danni Wang, Jinjing Hu, Xinrui Chen, Jingyi Yang, Yingying Li, Xinxuan Wang.  (2022)  Optimization of extraction and bioactivity detection of celery leaf flavonoids using BP neural network combined with genetic algorithm and response.  PREPARATIVE BIOCHEMISTRY & BIOTECHNOLOGY,      [PMID:34694209] [10.1080/10826068.2021.1983832]

6. Xueyao Wang, Qiang Li, Dongmei Yang, Xianhui An, Xueren Qian.  (2022)  Phytic Acid Doped Polyaniline as a Binding Coating Promoting Growth of Prussian Blue on Cotton Fibers for Adsorption of Copper Ions.  Coatings,  12  (2): (138).  [PMID:] [10.3390/coatings12020138]

7. Jintao Wang, Xinjie Wang, Lin Zhang, Luobin Zhang, Fangcheng Duan, Fengyi Wang, Weiwei Zhang, Jianqiang Wang, Zheng Zhang, Chunjin Hang, Hongtao Chen.  (2022)  A Multilayer Paste Based on Ag Nanoparticles with Cu@Sn for Die Attachment in Power Device Packaging.  Materials,  15  (3): (914).  [PMID:35160861] [10.3390/ma15030914]

8. Weiwei Zhang, Jiahao Liu, Luobin Zhang, Jianqiang Wang, Zheng Zhang, Jintao Wang, Hao Liu, Hongtao Chen, Mingyu Li.  (2021)  The synergistic effect of micron spherical and flaky silver-coated copper for conductive adhesives to achieve high electrical conductivity with low percolation threshold.  INTERNATIONAL JOURNAL OF ADHESION AND ADHESIVES,      [PMID:] [10.1016/j.ijadhadh.2021.102988]

9. Shupei Wang, Yahan Zhou, Wei Luo, Lili Deng, Shixiang Yao, Kaifang Zeng.  (2020)  Primary metabolites analysis of induced citrus fruit disease resistance upon treatment with oligochitosan, salicylic acid and Pichia membranaefaciens.  BIOLOGICAL CONTROL,      [PMID:] [10.1016/j.biocontrol.2020.104289]

10. Tao Chen, Yuhao Xiong, Yuemei Qin, Haiguan Yang, Peng Zhang, Fanggui Ye.  (2016)  Facile synthesis of low-cost biomass-based γ-Fe2O3/C for efficient adsorption and catalytic degradation of methylene blue in aqueous solution.  RSC Advances,  7  (1): (336-343).  [PMID:] [10.1039/C6RA24900K]

11. Zhijian Zha, Ruihua Wang, Qian Wang, Fahui Chen, Ziyang Ye, Yafeng Li.  (2024)  A fast and efficient liquid chromatography–tandem mass spectrometry method for measuring l- and d-amino acids in the urine of patients with immunoglobulin A nephropathy.  BIOMEDICAL CHROMATOGRAPHY,  38  (6): (e5866).  [PMID:38618866] [10.1002/bmc.5866]

12. Sijia Yang, Xiao Song, Ran Wei, Chuanjiang Zhou, Zhaoqiang Wu, Hong Chen.  (2025)  A Transparent, Abrasion-Resistant Anti-Fog Coating on Glass Substrates.  JOURNAL OF APPLIED POLYMER SCIENCE,      [PMID:] [10.1002/app.56818]

13. Mengwan Li, Dan Liu, Tingting Han, Juan Li, Linbo Chen, Daxiang Li, Zhongwen Xie.  (2024)  Comparative investigation of metabolite signatures and hypoadiposity effect between Dali tea and Yunkang tea.  Food Chemistry-X,      [PMID:39629280] [10.1016/j.fochx.2024.101989]

14. Yuan Jing-Bo, Feng Zhi-Hong, Li Dong-Chan, Luo Yang, Zhou Yun-Lei.  (2024)  Epidermal visualized health monitoring system based on stretchable and washable TPU hybrid conductive microtextiles.  RARE METALS,  43  (7): (3185-3193).  [PMID:] [10.1007/s12598-023-02543-2]

15. Guangxing Hu, Shuang Cui, Hongda Wang, Yan Shi, Zhuang Li.  (2024)  Mechanism of high sensitivity proton acids doped polypyrrole molecularly imprinted electrochemical sensor and its application in urea detection.  TALANTA,      [PMID:38986310] [10.1016/j.talanta.2024.126514]

16. Fang Li, Nuotong Shen, Qingcheng Li, Chen Yang, Limin Zhang, Mingjin Wang.  (2024)  Multiplexed microfluidic chip based flow injection analysis system for simultaneous determination of Fe(III), Mn(II) and Cu(II).  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2024.112346]

17. Jing Lv, Hui Ye, Guodong Yang, Shurui Han, Han Zhang, Yuzhong Zhang.  (2024)  Porous fluorine-cerium nanosheets anchored with FeOOH quantum dots for synergistic enhanced visible-light-driven photo-Fenton degradation of phenol.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:39471590] [10.1016/j.jcis.2024.10.131]

18. Tianlei Yang, Tao Li, Yueping Guan.  (2024)  Preparation of magnetic oil-based gel microspheres containing di(2-ethylhexyl)phosphoric acid for extraction of scandium ions at low concentrations in aqueous solutions.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2024.126270]

19. Wannan Hu, Kaixi Hu, Qinyu Zeng, Zengsheng Fang, Zhuocheng Wu, Jingyun Su, Xucun Ye, Luyang Wang, Lawrence Yoon Suk Lee.  (2025)  Microwave-assisted methanol–sulfosalicylic acid leaching system for efficient and closed-loop lithium-ion battery cathode recycling.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:40779868] [10.1016/j.jhazmat.2025.139415]

20. Zhang Yang, Wang Yuedan, Qing Xing, Wang Yao, Zhong Weibing, Wang Wenwen, Chen Yuanli, Liu Qiongzhen, Li Mufang, Wang Dong.  (2020)  Fiber organic electrochemical transistors based on multi-walled carbon nanotube and polypyrrole composites for noninvasive lactate sensing.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  412  (27): (7515-7524).  [PMID:32862271] [10.1007/s00216-020-02886-0]

21. Xing Qing, Yuedan Wang, Yang Zhang, Xincheng Ding, Weibing Zhong, Dong Wang, Wenwen Wang, Qiongzhen Liu, Ke Liu, Mufang Li, Zhentan Lu.  (2019)  Wearable Fiber-Based Organic Electrochemical Transistors as a Platform for Highly Sensitive Dopamine Monitoring.  ACS Applied Materials & Interfaces,      [PMID:30896142] [10.1021/acsami.9b00115]

22. Jing Lv, Hui Ye, Shurui Han, Jinli Zhao, Guodong Yang, Han Zhang, Xiaojian Fu, Jing Zhang, Qingping Xin, Lizhi Zhao, Hong Li, Ligang Lin, Xiaoli Ding, Yuzhong Zhang.  (2024)  Insights into pore structure-activity relationships of iron catalysts supported on fluorine–cerium nanosheets for heterogeneous Fenton oxidation.  Journal of Environmental Chemical Engineering,      [PMID:] [10.1016/j.jece.2024.114935]

23. Fengyun Zhang, Yaoqi Wei, Yaping Zhang, Huanhuan Zhang, Lei Jiang, Xiangfei Liang.  (2025)  Field-deployable spectrophotometric determination of uranium in aqueous systems using Br-PADAP.  Analytical Methods,      [PMID:40856760] [10.1039/D5AY01073J]

24. Yi Xiong, Wanhai Xiao, Wentao Li, Wenjing Zheng, Dong Wang, Jianwei Guo, Jianwei Cao, Tao Qi, Zhi Wang.  (2025)  A Novel Approach for Selective Removal of Aluminum Ion from Rare Earth Leaching Solution by Using Hydrotalcite as Solid Base.  ChemistrySelect,  10  (23): (e05506).  [PMID:] [10.1002/slct.202405506]

25. Yu Hengyi, Hu Qun, Liu Lu, Xiang Dong, Yang Guangjie, Wang Yaqin, Wang Zhen, Liu Dong, Liu Aiguo, Gong Xuepeng.  (2025)  A Novel Liquid Chromatography–Tandem Mass Spectrometry Method for Monitoring Plasma l-Asparaginase Activity in Pediatric Patients With Acute Lymphoblastic Leukemia Receiving Pegaspargase Treatment.  THERAPEUTIC DRUG MONITORING,      [PMID:40407759] [10.1097/FTD.0000000000001345]

26. Chenghang Li, Zhumei Luo, Shan Qing, Xiaohui Zhang, Zichang Shi, Guili He, Shuai Feng, Haoming Huang, Xiaoyu Huang, Jing Zhang.  (2026)  Programmable interfacial Nanofluids for high-heat-flux Chip cooling via heat networks.  APPLIED THERMAL ENGINEERING,      [PMID:] [10.1016/j.applthermaleng.2026.130142]