Triphenylphosphine-3,3′,3′′-trisulfonic acid trisodium salt - ≥90% , CAS No.63995-70-0

CAS: 63995-70-0 Cat. No.: T115579 Peso molecular: 568.42 Beilstein Registry Number: 3584807 Número EC: 264-596-6 PubChem CID: 6099338

GRADE & PURITY ≥90%

Synonyms

Tris(3-sulfophenyl)phosphine trisodium salt | Tris-(3-Sulfornatophenyl)-Phosphine4-Hydratesodiumsalt | trisodium 3-[bis(3-sulfonatophenyl)phosphino]benzenesulfonate | tris(3-sulfonatophenyl)phosphine sodium salt | Sodium 3,3',3''-phosphinetriyltribenzenes

Storage

Protected from light,Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Specifications

Sinónimos

Tris(3-sulfophenyl)phosphine trisodium salt | Tris-(3-Sulfornatophenyl)-Phosphine4-Hydratesodiumsalt | trisodium 3-[bis(3-sulfonatophenyl)phosphino]benzenesulfonate | tris(3-sulfonatophenyl)phosphine sodium salt | Sodium 3, 3', 3''-phosphinetriyltribenzenes

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged, Desiccated, Cool

Enviado en

Normal

Pureza

≥90%

Nombres e identificadores

• Pubchem Sid: 488195674
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488195674
• Sonrisas canónicas: C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
• IUPAC Name: trisodium;3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate
• InChIKey: MYAJTCUQMQREFZ-UHFFFAOYSA-K
• INCHI: 1S/C18H15O9PS3.3Na/c19-29(20,21)16-7-1-4-13(10-16)28(14-5-2-8-17(11-14)30(22,23)24)15-6-3-9-18(12-15)31(25,26)27;;;/h1-12H,(H,19,20,21)(H,22,23,24)(H,25,26,27);;;/q;3*+1/p-3
• Isómeros SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
• WGK Alemania: 1
• PubChem CID: 6099338
• Peso molecular: 568.42
• Beilstein: 3584807

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylphosphines and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylphosphines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylphosphines and derivatives
• Alternative Parents: Benzenesulfonic acids and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Sulfonyls Organosulfonic acids Organic phosphines and derivatives Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Triphenylphosphine - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Phenylphosphine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Phosphine - Organic alkali metal salt - Organophosphorus compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic sodium salt - Organic salt - Organic cation - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylphosphines and derivatives. These are compounds containing a phenylphosphine, which consists of phosphine substituent bound to a phenyl 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

• Sensibilidad: Moisture & air sensitive；Light sensitive
• Peso molecular: 568.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 567.907 Da
• Monoisotopic Mass: 567.907 Da
• Topological Polar Surface Area: 197.000 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 768.000
• 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: 4

XLogP3

Referencias

1. Yongjia Tang, Haoran Xu, Yaxue Dai, Fang Wang, Wenjing Huang, Peifei Liu, Yueqing Gu.  (2021)  A novel peptide targeting c-Met for hepatocellular carcinoma diagnosis.  Journal of Materials Chemistry B,  9  (22): (4577-4586).  [PMID:34047746] [10.1039/D1TB00408E]

2. Yuanbiao Tu, Ji Tao, Fang Wang, Peifei Liu, Zhihao Han, Zhaolun Li, Yi Ma, Yueqing Gu.  (2020)  A novel peptide targeting gastrin releasing peptide receptor for pancreatic neoplasm detection.  Biomaterials Science,  8  (9): (2682-2693).  [PMID:32266897] [10.1039/D0BM00162G]

3. Wang Hanqi, Cheng Fang, He Wei, Zhu Jiaohui, Cheng Gang, Qu Jingping.  (2017)  Poly(ethylene) glycol hydrogel based on oxa-Michael reaction: Precursor synthesis and hydrogel formation.  Biointerphases,  12  (2):   [PMID:28571325] [10.1116/1.4984305]

4. Sun Ke, Li Sicong, Zheng Bowen, Zhu Yanlei, Wang Tongyue, Liang Mingfu, Yao Yue, Zhang Kairan, Zhang Jizhong, Li Hongyong, Han Dongyang, Zheng Jishen, Coventry Brian, Cao Longxing, Baker David, Liu Lei, Lu Peilong.  (2024)  Accurate de novo design of heterochiral protein–protein interactions.  CELL RESEARCH,      [PMID:39143121] [10.1038/s41422-024-01014-2]

5. Lixian Huang, Jinzhe Liang, Jiaqi Lu, Min He, Yidong Bin, Yanni Luo, Shulin Zhao, Shengqiang Hu, Liangliang Zhang.  (2025)  A smart nanoprobe with simultaneously triggering reactive oxygen species and NIR-II fluorescence for enhanced chemodynamic/photodynamic therapy and ratiometric imaging- guided tumor resection.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2025.137971]