Potassium biphthalate（KHP） - PureSpectra™, Spectrum pure , CAS No.877-24-7

CAS: 877-24-7 Cat. No.: P112249 Formula: HOOCC₆H₄COOK Peso molecolare: 204.22 Beilstein Registry Number: 3637128 Numero EC: 212-889-4

GRADE & PURITY PureSpectra™, Spectrum pure

Synonyms

KHP | F1905-7235 | Hydrogen potassium phthalate | 1,2-Benzenedicarboxylic acid, monopotassium salt | KHP | 1,2-Benzenedicarboxylic acid, potassium salt (1:1) | N,N,N',N'-Tetramethyl-O-(benzotriazol-1-yl)uronium Hexafluorophosphate | DTXCID8022167 | P0309

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

KHP | F1905-7235 | Hydrogen potassium phthalate | 1,2-Benzenedicarboxylic acid, monopotassium salt | KHP | 1,2-Benzenedicarboxylic acid, potassium salt (1:1) | N,N,N',N'-Tetramethyl-O-(benzotriazol-1-yl)uronium Hexafluorophosphate | DTXCID8022167 | P0309

Specifiche e purezza

PureSpectra™, Spectrum pure

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Grado

PureSpectra™, Spectrum pure

Nomi e identificatori

Pubchem Sid

508816712

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508816712

Sorrisi canonici

C1=CC=C(C(=C1)C(=O)O)C(=O)[O-].[K+]

IUPAC Name

potassium;2-carboxybenzoate

InChIKey

IWZKICVEHNUQTL-UHFFFAOYSA-M

INCHI

1S/C8H6O4.K/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+1/p-1

Isomeri SMILES

C1=CC=C(C(=C1)C(=O)O)C(=O)[O-].[K+]

WGK Germania

2

RTECS

CZ4326000

Peso molecolare

204.22

Beilstein

3637128

Reaxy-Rn

3637128

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3637128&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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 potassium 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 potassium salt - Organic salt - Organooxygen compound - Aromatic homomonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive.
• Punto di fusione (°C): 295-300°C
• Peso molecolare: 204.220 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 203.982 Da
• Monoisotopic Mass: 203.982 Da
• Topological Polar Surface Area: 77.400 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 204.000
• 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