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Home > Encyclopedia > 4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone

4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone

4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone structure

4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone 

structure
  • CAS No:

    4388-07-2

  • Formula:

    C14H10O4

  • Chemical Name:

    4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone

  • Synonyms:

    [Bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone,4,4′-dimethyl-;2,2′-Bi-p-benzoquinone,5,5′-dimethyl-;4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone;5,5′-Bi-p-toluquinone;NSC 11851;5′,5′-Dimethyl-2,2′-bi-p-benzoquinone

4,4′-Dimethyl[bi-1,4-cyclohexadien-1-yl]-3,3′,6,6′-tetrone Basic Attributes

242.23

242.23

11851

Characteristics

68.3

0.5

1.1478 (rough estimate)

178-180 °C

305.05°C (rough estimate)

Abdominal cavity-mouse LDL0: 125 mg/kg

Thermal decomposition emits toxic and spicy irritating smoke

Safety Information

The warehouse is ventilated, low temperature and dry; stored separately from oxidants and acids

Toxicity

highly toxic

Computed Properties

Molecular Weight:242.23
XLogP3:0.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:242.05790880
Monoisotopic Mass:242.05790880
Topological Polar Surface Area:68.3
Heavy Atom Count:18
Complexity:568
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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