1-(2-Chloro-4-pyridinyl)-1,5-hexanedione
[CAS# 898785-33-6]

Identification

• Name: 1-(2-Chloro-4-pyridinyl)-1,5-hexanedione
• Synonyms: 1-(3-Chloro-4-pyridyl)-1,5-hexanedione
• Molecular Formula: C₁₁H₁₂ClNO₂
• Molecular Weight: 225.67
• CAS Registry Number: 898785-33-6
• SMILES: O=C(CCCC(C)=O)c1ccnc(Cl)c1
• InChI: 1S/C11H12ClNO2/c1-8(14)3-2-4-10(15)9-5-6-13-11(12)7-9/h5-7H,2-4H2,1H3
• InChIKey: WNSPPOAPQDYPKR-UHFFFAOYSA-N

Properties

• Density: 1.192g/cm³ (Cal.)
• Boiling point: 385.507°C at 760 mmHg (Cal.)
• Flash point: 186.948°C (Cal.)
• Refractive index: 1.523 (Cal.)