6,13-Pentacenedione-d12

• CAT Number: R062235
• CAS Number: 68234-48-0
• Molecular Formula: C22H12O2
• Molecular Weight: 320.409
• Purity: ≥95%
• Synonyms: 6,13-Pentacenequinone-d12
• Storage: Store at -20°C
• IUPAC Name: 1,2,3,4,5,7,8,9,10,11,12,14-dodecadeuteriopentacene-6,13-dione
• InChI: InChI=1S/C22H12O2/c23-21-17-9-13-5-1-2-6-14(13)10-18(17)22(24)20-12-16-8-4-3-7-15(16)11-19(20)21/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
• InChIKey: UFCVADNIXDUEFZ-AQZSQYOVSA-N
• SMILES: [2H]C1=C(C(=C2C(=C3C(=C(C2=C1[2H])[2H])C(=O)C4=C(C5=C(C(=C(C(=C5C(=C4C3=O)[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]

6,13-Pentacenedione-d12 is a deuterated form of 6,13-pentacenedione, a polycyclic aromatic hydrocarbon known for its potential in organic electronics and materials science. The twelve deuterium atoms replace hydrogen atoms, enabling precise tracking and analysis using NMR spectroscopy and mass spectrometry. This isotopic labeling is valuable for studying the compound’s electronic properties, chemical reactivity, and interaction with other molecules. 6,13-Pentacenedione-d12 is used in research to optimize material properties, investigate reaction mechanisms, and develop new applications in organic semiconductors and molecular electronics.