1,1'-(2,6-Dimethyl-1,4-Dihydropyridine-3,5-Diyl)Diethanone Hydrate (1:1)
[CAS# 412009-36-0]

Identification

• Name: 1,1'-(2,6-Dimethyl-1,4-Dihydropyridine-3,5-Diyl)Diethanone Hydrate (1:1)
• Synonyms: 1,1'-(2,6-dimethyl-1,4-dihydropyridine-3,5-diyl)diethanone hydrate; 3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine, hydrate
• Molecular Formula: C₁₁H₁₇NO₃
• Molecular Weight: 211.26
• CAS Registry Number: 412009-36-0
• SMILES: O.O=C(C)C=1C/C(=C(/C)NC=1C)C(C)=O
• InChI: 1S/C11H15NO2.H2O/c1-6-10(8(3)13)5-11(9(4)14)7(2)12-6;/h12H,5H2,1-4H3;1H2
• InChIKey: WDVIKOHKFUJTOM-UHFFFAOYSA-N

Properties

• Boiling point: 415.6°C at 760 mmHg (Cal.)
• Flash point: 205.2°C (Cal.)
• Refractive index: (Cal.)