1,6-Dideuteriohexa-1,5-Diyne
[CAS# 73385-31-6]

Identification

• Name: 1,6-Dideuteriohexa-1,5-Diyne
• Synonyms: 1,5-Hexadiyne-1,6-D2
• Molecular Formula: C₆H₄D₂
• Molecular Weight: 80.13
• CAS Registry Number: 73385-31-6
• SMILES: C(C#C[2H])CC#C[2H]
• InChI: 1S/C6H6/c1-3-5-6-4-2/h1-2H,5-6H2/i1D,2D
• InChIKey: YFIBSNDOVCWPBL-QDNHWIQGSA-N

Properties

• Density: 0.795g/cm³ (Cal.)
• Boiling point: 66.074°C at 760 mmHg (Cal.)
• Flash point: -28.117°C (Cal.)

References

• (1): T. Hosoya, H. Uekusa, Y. Ohashi, T. Ohhara, I. Tanaka and N. Niimura. Neutron diffraction analysis of deuterium transfer in chiral [beta]-thiolactam formation in the crystalline state, Acta Cryst. (2006). B62, 153-160