Pentafluoropropionic Acid Anhydride（PFAA） - for GC derivatization, ≥99% , CAS No.356-42-3

CAS: 356-42-3 Cat. No.: P122803 Formula: C₆F₁₀O₃ Peso molecolare: 310.05 Beilstein Registry Number: 1806446 Numero EC: 206-604-2

QUALITÀ & PUREZZA for GC derivatization, ≥99%

Synonyms

PFAA | 0LFE7U11O5 | AKOS005063449 | PENTAFLUOROPROPIONYL ANHYDRIDE | Propanoic acid, pentafluoro-, anhydride | 2,2,3,3,3-pentafluoropropanoic anhydride | C6F10O3 | FT-0676418 | MFCD00000429 | Pentafluoropropionic anhydride, 99% | Pentafluoropropionic anhy

Storage

Argon charged,Room temperature

Shipped In

Normal

Panoramica

Derivatization reagent used in a GC-MS analysis of stereoisomer content of synthetic peptides. Also used in a GC-MS detection method for synephrine in dietary supplements. For the preparation of volatile pentafluoropropionyl derivatives of a wide range of compounds, for example, amines and alcohols, for EC/GC.

Specifiche

Sinonimi

PFAA | 0LFE7U11O5 | AKOS005063449 | PENTAFLUOROPROPIONYL ANHYDRIDE | Propanoic acid, pentafluoro-, anhydride | 2,2,3,3,3-pentafluoropropanoic anhydride | C6F10O3 | FT-0676418 | MFCD00000429 | Pentafluoropropionic anhydride, 99% | Pentafluoropropionic anhy

Specifiche e purezza

for GC derivatization, ≥99%

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Grado

for GC derivatization

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

528769801

Sorrisi canonici

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

IUPAC Name

2,2,3,3,3-pentafluoropropanoyl 2,2,3,3,3-pentafluoropropanoate

InChIKey

XETRHNFRKCNWAJ-UHFFFAOYSA-N

INCHI

1S/C6F10O3/c7-3(8,5(11,12)13)1(17)19-2(18)4(9,10)6(14,15)16

Isomeri SMILES

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

WGK Germania

3

Peso molecolare

310.05

Beilstein

1806446

Reaxy-Rn

1806446

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1806446&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Alkyl halides
• Subclass: Alkyl fluorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Perfluoroalkyl carboxylic acid and derivatives
• Alternative Parents: Dicarboxylic acids and derivatives Carboxylic acid anhydrides Alpha-halocarboxylic acid derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Perfluoroalkyl carboxylic acid or derivatives - Dicarboxylic acid or derivatives - Carboxylic acid anhydride - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Carbonyl group - Aliphatic acyclic compound
• Descrizione: 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: 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

• Solubilità: Reacts with water.
• Sensibilità: Moisture sensitive.
• Indice di rifrazione: 1.3
• Punto di ebollizione (°C): 69°C
• Peso molecolare: 310.050 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 4
• Exact Mass: 309.969 Da
• Monoisotopic Mass: 309.969 Da
• Topological Polar Surface Area: 43.400 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 342.000
• 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