2-(((4-Methyl-3-Oxido-2,3-Dihydro-2-Quinazolinyl)Methyl)Thio)Ethanol
[CAS# 6965-81-7]

Identification

• Name: 2-(((4-Methyl-3-Oxido-2,3-Dihydro-2-Quinazolinyl)Methyl)Thio)Ethanol
• Synonyms: 2-[(4-Methyl-3-Oxido-Quinazolin-3-Ium-2-Yl)Methylsulfanyl]Ethanol; 2-[(4-Methyl-3-Oxido-2-Quinazolin-3-Iumyl)Methylthio]Ethanol; 2-[(4-Methyl-3-Oxido-Quinazolin-3-Ium-2-Yl)Methylthio]Ethanol
• Molecular Formula: C₁₂H₁₄N₂O₂S
• Molecular Weight: 250.31
• CAS Registry Number: 6965-81-7
• SMILES: C1=CC=CC2=C1C(=[N+](C(=N2)CSCCO)[O-])C
• InChI: 1S/C12H14N2O2S/c1-9-10-4-2-3-5-11(10)13-12(14(9)16)8-17-7-6-15/h2-5,15H,6-8H2,1H3
• InChIKey: CKKKMBQXGUQQAC-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 501.614°C at 760 mmHg (Cal.)
• Flash point: 257.167°C (Cal.)