Chrysene-d12

• CAT Number: R053032
• CAS Number: 1719-03-5
• Molecular Formula: C18H12
• Molecular Weight: 240.367
• Purity: ≥95%
• Synonyms: 1,2-Benzophenanthrene-d12; 1,2-Benzphenanthrene-d12; Benzo[a]phenanthrene-d12; NSC 6175-d12; [4]Phenacene-d12; Dodecadeuteriochrysene; Perdeuteriochrysene
• Storage: -20°C
• IUPAC Name: 1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriochrysene
• InChI: InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
• InChIKey: WDECIBYCCFPHNR-AQZSQYOVSA-N
• SMILES: [2H]C1=C(C(=C2C(=C1[2H])C(=C(C3=C2C(=C(C4=C(C(=C(C(=C43)[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]

Chrysene-d12 is a deuterated form of chrysene, a polycyclic aromatic hydrocarbon (PAH) known for its use in environmental and chemical research. With twelve deuterium atoms, this compound enhances the precision of analytical techniques such as NMR and mass spectrometry. Chrysene-d12 is used to study the environmental behavior, metabolism, and toxicology of PAHs. It serves as a tracer in understanding the pathways of PAH degradation and transformation in various environments. In organic chemistry, it aids in investigating reaction mechanisms and the synthesis of PAH derivatives, contributing to research in environmental science, chemistry, and material science.