3,7-Dimethyl-2,6-Octadienal Thiosemicarbazone
[CAS# 54097-74-4]

Identification

• Name: 3,7-Dimethyl-2,6-Octadienal Thiosemicarbazone
• Synonyms: [[(2E)-3,7-Dimethylocta-2,6-Dienylidene]Amino]Thiourea; Nciopen2_006944; 2,6-Octadienal, 3,7-Dimethyl-, Thiosemicarbazone
• Molecular Formula: C₁₁H₁₉N₃S
• Molecular Weight: 225.35
• CAS Registry Number: 54097-74-4
• SMILES: C(/C(=C/C=N/NC(=S)N)C)CC=C(C)C
• InChI: 1S/C11H19N3S/c1-9(2)5-4-6-10(3)7-8-13-14-11(12)15/h5,7-8H,4,6H2,1-3H3,(H3,12,14,15)/b10-7+,13-8+
• InChIKey: OVUJOZUSCSTKGA-OOHIBURESA-N

Properties

• Density: 1.015g/cm³ (Cal.)
• Boiling point: 351.901°C at 760 mmHg (Cal.)
• Flash point: 166.624°C (Cal.)