tert-Butyl hydroperoxide solution - 5.0-6.0 M in decane , CAS No.75-91-2

CAS: 75-91-2 Cat. No.: T466691 Summenformel: C₄H₁₀O₂ Molekulargewicht: 90.12 Beilstein Registry Number: 1098280 EG-Nummer: 200-915-7

GRADE & PURITY 5.0-6.0 M in decane

Synonyms

tert.-butylhydroperoxide | tertiarybutylhydroperoxide | t-butyl-hydrogenperoxide | DTXSID9024693 | Hydroperoxide, 1,1-dimethylethyl | Hydroperoxide, 1,1-dimethylethyl- | Hydroperoxyde de butyle tertiaire | NCGC00090725-01 | UNII-955VYL842B | NSC672 | NSC-

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads,FedEx DG Service

Übersicht

tert-butyl hydroperoxide (tert-butyl hydroperoxide) is an organic peroxide used in oxidation processes.

Applications

tert-butyl hydroperoxide can be used for:

Osmium-catalyzed ortho-hydroxylation of alkenes under basic conditions

Catalytic asymmetric oxidation of sulfides to sulfoxides using binaphthol as a chiral auxiliary

Oxidation of dibenzothiophene

Specifications

Synonyme

tert.-butylhydroperoxide | tertiarybutylhydroperoxide | t-butyl-hydrogenperoxide | DTXSID9024693 | Hydroperoxide, 1,1-dimethylethyl | Hydroperoxide, 1,1-dimethylethyl- | Hydroperoxyde de butyle tertiaire | NCGC00090725-01 | UNII-955VYL842B | NSC672 | NSC-

Spezifikationen & Reinheit

5.0-6.0 M in decane

Storage

Protected from light,Store at -20°C

Verschickt in

Ice chest + Ice pads,FedEx DG Service

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

IUPAC Name

2-hydroperoxy-2-methylpropane

InChIKey

CIHOLLKRGTVIJN-UHFFFAOYSA-N

Isomere SMILES

CC(C)(C)OO

WGK Deutschland

3

UN-Nummer

3109

Molekulargewicht

90.12

Beilstein

1098280

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organic hydroperoxides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organic hydroperoxides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic hydroperoxides
• Alternative Parents: Peroxols Alkyl hydroperoxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydroperoxide - Alkyl hydroperoxide - Peroxol - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as organic hydroperoxides. These are organic compounds comprising the hydroperoxide functional group, with the general formula [O-O]2-.
• External Descriptors: an organic hydroperoxide

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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light and heat sensitive
• Brechungsindex: 1.4007
• Flammpunkt (°F): 107.6 °F
• Flammpunkt (°C): 43 °C
• Siedepunkt (°C): 89°C
• Schmelzpunkt (°C): -3°C
• Molekulargewicht: 90.120 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 90.0681 Da
• Monoisotopic Mass: 90.0681 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 35.300
• 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