3-Benzyl-2,3-Dihydro-2,2-Dimethylquinazoline-4(1H)-Thione
[CAS# 63991-68-4]

Identification

• Name: 3-Benzyl-2,3-Dihydro-2,2-Dimethylquinazoline-4(1H)-Thione
• Synonyms: 3-(Benzyl)-2,2-Dimethyl-1H-Quinazoline-4-Thione; 4(1H)-Quinazolinethione, 2,3-Dihydro-3-Benzyl-2,2-Dimethyl-; 2,3-Dihydro-2,2-Dimethyl-3-(Phenylmethyl)-4(1H)-Quinazolinethione
• Molecular Formula: C₁₇H₁₈N₂S
• Molecular Weight: 282.40
• CAS Registry Number: 63991-68-4
• SMILES: C1=CC=CC2=C1C(N(C(N2)(C)C)CC3=CC=CC=C3)=S
• InChI: 1S/C17H18N2S/c1-17(2)18-15-11-7-6-10-14(15)16(20)19(17)12-13-8-4-3-5-9-13/h3-11,18H,12H2,1-2H3
• InChIKey: KJDOWELVVSEMAG-UHFFFAOYSA-N

Properties

• Density: 1.213g/cm³ (Cal.)
• Boiling point: 428.558°C at 760 mmHg (Cal.)
• Flash point: 212.984°C (Cal.)