2-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrile
[CAS# 898762-84-0]

Identification

• Name: 2-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrile
• Synonyms: 2-cyano-3'-thiomorpholinomethyl benzophenone
• Molecular Formula: C₁₉H₁₈N₂OS
• Molecular Weight: 322.42
• CAS Registry Number: 898762-84-0
• SMILES: N#Cc1ccccc1C(=O)c3cc(CN2CCSCC2)ccc3
• InChI: 1S/C19H18N2OS/c20-13-17-5-1-2-7-18(17)19(22)16-6-3-4-15(12-16)14-21-8-10-23-11-9-21/h1-7,12H,8-11,14H2
• InChIKey: FPPWXMZPQWVARZ-UHFFFAOYSA-N

Properties

• Density: 1.259g/cm³ (Cal.)
• Boiling point: 544.296°C at 760 mmHg (Cal.)
• Flash point: 282.98°C (Cal.)
• Refractive index: 1.653 (Cal.)