Gentisyl quinone isovalerate - CAS 849762-24-9

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Catalog Number: H000012

CAS Number: 849762-24-9

PubChem Substance ID:355170201

Molecular Formula: C12H14O4

Molecular Weight:222.24

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

• Synonyms: (3,6-dioxocyclohexa-1,4-dien-1-yl)methyl3-methylbutanoate;Blattellaquinone

Property

• Molecular Formula: C12H14O4
• Molecular Weight: 222.24
• Purity: ≥95%
• Storage: -20°C

Computed Descriptor

• IUPAC Name: (3,6-dioxocyclohexa-1,4-dien-1-yl)methyl 3-methylbutanoate
• 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: CC(C)CC(=O)OCC1=CC(=O)C=CC1=O