ChemicalBook--->CAS DataBase List--->849762-24-9

849762-24-9

849762-24-9 Structure

849762-24-9 Structure
IdentificationBack Directory
[Name]

BLATTELLAQUINONE
[CAS]

849762-24-9
[Synonyms]

100G;1KG
Blattellaqinone
BLATTELLAQUINONE
Blattellaquinone 97%+
Gentisyl Quinone Isovalerate
(3,6-Dioxocyclohexa-1,4-dien-1-yl)
(3,6-dioxocyclohexa-1,4-dienyl)methyl 3-methylbutanoate
3-Methyl-,(3,6-dioxo-1,4-cyclohexadien-1-yl)Methyl ester
(3,6-Dioxocyclohexa-1,4-dien-1-yl)Methyl 3-Methylbutanoate
Butanoic acid, 3-Methyl-, (3,6-dioxo-1,4-cyclohexadien-1-yl)Methyl ester
[Molecular Formula]

C12H14O4
[MDL Number]

MFCD08752330
[MOL File]

849762-24-9.mol
[Molecular Weight]

222.24
Chemical PropertiesBack Directory
[Melting point ]

46-47 °C(Solv: hexane (110-54-3))
[Boiling point ]

314.4±21.0 °C(Predicted)
[density ]

1.160±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

Pale Brown to Very Dark Beige
[InChI]

InChI=1S/C12H14O4/c1-8(2)5-12(15)16-7-9-6-10(13)3-4-11(9)14/h3-4,6,8H,5,7H2,1-2H3
[InChIKey]

JVMUMZYOAWLJQW-UHFFFAOYSA-N
[SMILES]

C(OCC1C(=O)C=CC(=O)C=1)(=O)CC(C)C
Hazard InformationBack Directory
[Uses]

Blattellaquinone is a sex pheromone of German cockroach (Blatella germanica).
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