Ftalato disódico - ≥95%(T) , CAS No.15968-01-1

CAS: 15968-01-1 Cat. No.: D154289 Peso molecular: 210.1 Número EC: 240-106-6

GRADE & PURITY ≥95%(T)

Synonyms

Disodium phthalate | AS-67578 | 1,2-Benzenedicarboxylic acid, sodium salt (1:2) | P0400 | W-110422 | Phthalic acid,sodium salt | disodium;phthalate | QB14YV193C | O-PHTHALIC ACID DISODIUM SALT | EC 240-106-6 | DTXSID60889651 | HQWKKEIVHQXCPI-UHFFFAOYSA-L

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

Disodium phthalate | AS-67578 | 1, 2-Benzenedicarboxylic acid, sodium salt (1:2) | P0400 | W-110422 | Phthalic acid, sodium salt | disodium;phthalate | QB14YV193C | O-PHTHALIC ACID DISODIUM SALT | EC 240-106-6 | DTXSID60889651 | HQWKKEIVHQXCPI-UHFFFAOYSA-L

Especificaciones y pureza

≥95%(T)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥95%(T)

Nombres e identificadores

• Pubchem Sid: 504755796
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755796
• Sonrisas canónicas: C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Na+].[Na+]
• IUPAC Name: disodium;phthalate
• InChIKey: HQWKKEIVHQXCPI-UHFFFAOYSA-L
• INCHI: 1S/C8H6O4.2Na/c9-7(10)5-3-1-2-4-6(5)8(11)12;;/h1-4H,(H,9,10)(H,11,12);;/q;2*+1/p-2
• Isómeros SMILES: C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Na+].[Na+]
• Peso molecular: 210.1
• Reaxy-Rn: 3919451
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3919451&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzoic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoic acids
• Alternative Parents: Benzoyl derivatives Dicarboxylic acids and derivatives Carboxylic acid salts Carboxylic acids Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzoic acid - Benzoyl - Dicarboxylic acid or derivatives - Carboxylic acid salt - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organooxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl 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
• Peso molecular: 210.090 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 209.99 Da
• Monoisotopic Mass: 209.99 Da
• Topological Polar Surface Area: 80.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 166.000
• 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. Yong-Hui Zhang, Zuo-Bei Wang, Adenike Bernice Eloise Adeoye, Yi-Fan Wang, You-Gui Huang, Xin Ye, Wei Wang.  (2024)  Continuous phosphorus elimination from low concentration wastewater by a calcium-doped lanthanum carbonate adsorbent.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2024.131204]

2. Zhuowen Wang, Sibei Liu, Songhao Cui, Baojian Jing, Shan Qiu, Fengxia Deng.  (2024)  Electrochemical disinfection boosting by a pulsed-assisted MXene-based cathode.  ELECTROCHIMICA ACTA,      [PMID:] [10.1016/j.electacta.2024.144232]