1-(2-Chloro-4-pyridinyl)-4-methyl-1-pentanone
[CAS# 898785-67-6]

Identification

• Name: 1-(2-Chloro-4-pyridinyl)-4-methyl-1-pentanone
• Synonyms: 3-Chloro-4-pyridyl 3-methylbutyl ketone
• Molecular Formula: C₁₁H₁₄ClNO
• Molecular Weight: 211.69
• CAS Registry Number: 898785-67-6
• SMILES: O=C(CCC(C)C)c1ccnc(Cl)c1
• InChI: 1S/C11H14ClNO/c1-8(2)3-4-10(14)9-5-6-13-11(12)7-9/h5-8H,3-4H2,1-2H3
• InChIKey: QQKJLIPLUZGHBZ-UHFFFAOYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 319.45°C at 760 mmHg (Cal.)
• Flash point: 146.999°C (Cal.)
• Refractive index: 1.511 (Cal.)