2-Diethylaminoethylsulfanyl-Pyridin-3-Yl-Methanone
[CAS# 57336-05-7]

Identification

• Name: 2-Diethylaminoethylsulfanyl-Pyridin-3-Yl-Methanone
• Synonyms: 3-Pyridinecarbothioic Acid S-(2-Diethylaminoethyl) Ester; Pyridine-3-Carbothioic Acid S-(2-Diethylaminoethyl) Ester; 3-Pyridinecarbothioic Acid, S-(2-(Diethylamino)Ethyl) Ester
• Molecular Formula: C₁₂H₁₈N₂OS
• Molecular Weight: 238.35
• CAS Registry Number: 57336-05-7
• SMILES: C1=NC=CC=C1C(=O)SCCN(CC)CC
• InChI: 1S/C12H18N2OS/c1-3-14(4-2)8-9-16-12(15)11-6-5-7-13-10-11/h5-7,10H,3-4,8-9H2,1-2H3
• InChIKey: PIGWQFXBEUEJSB-UHFFFAOYSA-N

Properties

• Density: 1.094g/cm³ (Cal.)
• Boiling point: 333.091°C at 760 mmHg (Cal.)
• Flash point: 155.248°C (Cal.)