2,5-Dimethyl-2,5-di(tert-butylperoxy)hexane - ≥93% , CAS No.78-63-7

CAS: 78-63-7 Cat. No.: T110273 Molecular Weight: 290.44 EC Number: 201-128-1 PubChem CID: 6545

GRADE & PURITY ≥93%

Synonyms

FT-0610430 | (1,4,4-Tetramethyltetramethylene)bis[tert-butyl peroxide] | CT 8 (crosslinking agent) | Kayahexa AD 40 | BRN 1863369 | H11786 | Kayahexa AD | VAROX DBPH | 2,5-Dimethyl-2,5-bis(tert-butylhydroperoxy)hexane | 2,5-Dimethyl-2,5-bis(tert-butylpero

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifications

Synonyms

FT-0610430 | (1, 4, 4-Tetramethyltetramethylene)bis[tert-butyl peroxide] | CT 8 (crosslinking agent) | Kayahexa AD 40 | BRN 1863369 | H11786 | Kayahexa AD | VAROX DBPH | 2, 5-Dimethyl-2, 5-bis(tert-butylhydroperoxy)hexane | 2, 5-Dimethyl-2, 5-bis(tert-butylpero

Specifications & Purity

≥93%

Storage

Store at 2-8°C

Shipped In

Wet ice, FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥93%

Names and Identifiers

• Canonical Smiles: CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C
• IUPAC Name: 2,5-bis(tert-butylperoxy)-2,5-dimethylhexane
• InChIKey: DMWVYCCGCQPJEA-UHFFFAOYSA-N
• INCHI: 1S/C16H34O4/c1-13(2,3)17-19-15(7,8)11-12-16(9,10)20-18-14(4,5)6/h11-12H2,1-10H3
• Isomeric SMILES: CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C
• WGK Germany: 3
• PubChem CID: 6545
• UN Number: 3108
• Molecular Weight: 290.44

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organic oxides
      • Subclass Organic peroxides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organic oxides
• Subclass: Organic peroxides
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl peroxides
• Alternative Parents: Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl peroxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as dialkyl peroxides. These are organic compounds containing a peroxide group substituted by two alkyl groups.
• 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

Associated Targets(Human)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Flash Point(°F): 65 °C
• Flash Point(°C): 65°C
• Boil Point(°C): 55-57°C/7mmHg
• Molecular Weight: 290.440 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 290.246 Da
• Monoisotopic Mass: 290.246 Da
• Topological Polar Surface Area: 36.900 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 252.000
• 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

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