4-Allyl-5-[4-(diethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
[CAS# 669748-48-5]

Identification

• Name: 4-Allyl-5-[4-(diethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
• Synonyms: 5-[4-(diethylamino)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol; 5-[4-(diethylamino)phenyl]-4-prop-2-enyl-1,2,4-triazole-3-thiol; MFCD03900787
• Molecular Formula: C₁₅H₂₀N₄S
• Molecular Weight: 288.41
• CAS Registry Number: 669748-48-5
• SMILES: CCN(CC)C1=CC=C(C=C1)C2=NN=C(N2CC=C)S
• InChI: 1S/C15H20N4S/c1-4-11-19-14(16-17-15(19)20)12-7-9-13(10-8-12)18(5-2)6-3/h4,7-10H,1,5-6,11H2,2-3H3,(H,17,20)
• InChIKey: RAGPQLCQEQJMOG-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 460.0±55.0°C at 760 mmHg (Cal.)
• Flash point: 232.0±31.5°C (Cal.)
• Refractive index: 1.604 (Cal.)

Safety Data

• Safety Description: IRRITANT