2-[(3,5-Dimethyl-1H-Pyrazol-4-Yl)Sulfanyl]Aniline
[CAS# 150536-99-5]

Identification

• Name: 2-[(3,5-Dimethyl-1H-Pyrazol-4-Yl)Sulfanyl]Aniline
• Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]aniline; MFCD00448901; ZINC00086057
• Molecular Formula: C₁₁H₁₃N₃S
• Molecular Weight: 219.31
• CAS Registry Number: 150536-99-5
• SMILES: CC1=C(C(=NN1)C)SC2=CC=CC=C2N
• InChI: 1S/C11H13N3S/c1-7-11(8(2)14-13-7)15-10-6-4-3-5-9(10)12/h3-6H,12H2,1-2H3,(H,13,14)
• InChIKey: OXZGNCVDJZPDAX-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 362.7±42.0°C at 760 mmHg (Cal.)
• Flash point: 173.1±27.9°C (Cal.)
• Refractive index: 1.666 (Cal.)