Tétrafluorohydroquinone - ≥97%(GC) , CAS No.771-63-1

CAS: 771-63-1 Cat. No.: T162225 Formule: C₆H₂F₄O₂ Poids moléculaire: 182.07 Beilstein Registry Number: 6(4)5766 Numéro CE: 212-237-9 PubChem CID: 69870

GRADE & PURITY ≥97%(GC)

Synonyms

Tetrafluoro-1,4-hydroquinone | 1,4-dihydroxy-2,3,5,6-tetrafluorobenzene | 1,4-Benzenediol, 2,3,5,6-tetrafluoro- | EINECS 212-237-9 | TETRAFLUORO-1,4-BENZENEDIOL | 2,3,5,6-Tetrafluorohydroquinone | SCHEMBL69958 | AM20041151 | 1,4-dihydroxytetrafluorobenzen

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonymes

Tetrafluoro-1,4-hydroquinone | 1,4-dihydroxy-2,3,5,6-tetrafluorobenzene | 1,4-Benzenediol, 2,3,5,6-tetrafluoro- | EINECS 212-237-9 | TETRAFLUORO-1,4-BENZENEDIOL | 2,3,5,6-Tetrafluorohydroquinone | SCHEMBL69958 | AM20041151 | 1,4-dihydroxytetrafluorobenzen

Spécifications et pureté

≥97%(GC)

Conditions de stockage de stockage

Argon charged,Room temperature

Expédié en

Normal

Pureté

≥97%(GC)

Noms et identifiants

• Pubchem Sid: 504754456
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754456
• Sourires canoniques: C1(=C(C(=C(C(=C1F)F)O)F)F)O
• IUPAC Name: 2,3,5,6-tetrafluorobenzene-1,4-diol
• InChIKey: ZSDAMBJDFDRLSS-UHFFFAOYSA-N
• INCHI: 1S/C6H2F4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11/h11-12H
• Isomères SMILES: C1(=C(C(=C(C(=C1F)F)O)F)F)O
• PubChem CID: 69870
• Poids moléculaire: 182.07
• Beilstein: 6(4)5766
• Reaxy-Rn: 1876291

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass 1,4-dihydroxy-2-halobenzenoids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: 1,4-dihydroxy-2-halobenzenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,4-dihydroxy-2-halobenzenoids
• Alternative Parents: O-fluorophenols M-fluorophenols Hydroquinones Fluorobenzenes Aryl fluorides Organooxygen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1,4-dihydroxy-2-halobenzenoid - 3-halophenol - 2-halophenol - Hydroquinone - 3-fluorophenol - 2-fluorophenol - Fluorobenzene - Halobenzene - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,4-dihydroxy-2-halobenzenoids. These are aromatic compounds containing a 1,-2-dihydroxybenzene moiety, which carries an halogen atom at the ring 2-position.
• 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

Propriétés chimiques et physiques

• Solubilité: Soluble in Methanol
• Sensibilité: air sensitive
• Point de fusion (°C): 168-170°C
• Poids moléculaire: 182.070 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 181.999 Da
• Monoisotopic Mass: 181.999 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 134.000
• 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

Références

1. Xiaoyu He, Wangcheng Lan, Yuancai Lv, Xiaojing Li, Chen Tian.  (2026)  Efficiently Monitoring Trace Nitrophenol Pollutants in Water Through the Dispersive Solid-Phase Extraction Based on Porous Organic Polymer-Modified Cellulose Nanofiber Membrane.  Chemosensors,  14  (2): (31).  [PMID:] [10.3390/chemosensors14020031]