Nonafluorovaleric Acid - ≥97% , CAS No.2706-90-3

CAS: 2706-90-3 Cat. No.: N159620 Fórmula: C₅HF₉O₂ Peso molecular: 264.05 Beilstein Registry Number: 1800090 Número EC: 220-300-7

GRADE & PURITY ≥97%

Synonyms

NCI-293015 | 2-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-imidazo(4,5-c)pyridine | FT-0634452 | FX8Q9PI4VP | Perfluoropentanoic acid, 97% | UNII-LUW3UY784P | (4-Chlorophenylsulfonyl)acetic acid | SCHEMBL64889 | 1ST9515 | InChI=1/C5HF9O2/c6-2(7,1(15)16)3(8,9)

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

Perfluoropentanoic acid, also known as nonafluoropentanoic acid, is a monocarboxylic acid that can be utilized as a surfactant，surface protector, stain repellent, fire-fighting foam, emulsifier, and also in the production of fluoropolymers.

Application：

An emulsifying agent for polymer dispersion, extinction foams, stain repellents, additives for paints, and coatings；A powerful cation exchanger in ion-pairing chromatography.

Specifications

Sinónimos

NCI-293015 | 2-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-imidazo(4,5-c)pyridine | FT-0634452 | FX8Q9PI4VP | Perfluoropentanoic acid, 97% | UNII-LUW3UY784P | (4-Chlorophenylsulfonyl)acetic acid | SCHEMBL64889 | 1ST9515 | InChI=1/C5HF9O2/c6-2(7,1(15)16)3(8,9)

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

Pubchem Sid

504755006

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755006

Sonrisas canónicas

C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O

IUPAC Name

2,2,3,3,4,4,5,5,5-nonafluoropentanoic acid

InChIKey

CXZGQIAOTKWCDB-UHFFFAOYSA-N

INCHI

1S/C5HF9O2/c6-2(7,1(15)16)3(8,9)4(10,11)5(12,13)14/h(H,15,16)

Isómeros SMILES

C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O

WGK Alemania

3

Peso molecular

264.05

Beilstein

1800090

Reaxy-Rn

1800087

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1800087&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Alkyl halides
      • Subclass Alkyl fluorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Alkyl halides
• Subclass: Alkyl fluorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Perfluoroalkyl carboxylic acid and derivatives
• Alternative Parents: Halogenated fatty acids Alpha-halocarboxylic acids Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Perfluoroalkyl carboxylic acid or derivatives - Halogenated fatty acid - Fatty acyl - Fatty acid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organofluoride - Organooxygen compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as perfluoroalkyl carboxylic acid and derivatives. These are organic compounds containing an alkyl chain attached to the C-alpha of a carboxylic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine atoms.
• External Descriptors: fluoroalkanoic acid

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: Partly soluble in water.
• Sensibilidad: air sensitive
• Índice de refracción: n20/D 1.294
• Punto de ebullición (°C): 70°C
• Peso molecular: 264.050 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 3
• Exact Mass: 263.983 Da
• Monoisotopic Mass: 263.983 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 291.000
• 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: 1