(2S,5S)-1-(Chloroacetyl)-5-methyl-2-pyrrolidinecarbonitrile
[CAS# 676561-06-1]

Identification

• Name: (2S,5S)-1-(Chloroacetyl)-5-methyl-2-pyrrolidinecarbonitrile
• Synonyms: (2S,5S)-1-(2-chloroacetyl)-5-methylpyrrolidine-2-carbonitrile
• Molecular Formula: C₈H₁₁ClN₂O
• Molecular Weight: 186.64
• CAS Registry Number: 676561-06-1
• SMILES: O=C(N1[C@H](C#N)CC[C@@H]1C)CCl
• InChI: 1S/C8H11ClN2O/c1-6-2-3-7(5-10)11(6)8(12)4-9/h6-7H,2-4H2,1H3/t6-,7-/m0/s1
• InChIKey: UIOKZYVYOSVJDA-BQBZGAKWSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 358.689°C at 760 mmHg (Cal.)
• Flash point: 170.729°C (Cal.)
• Refractive index: 1.511 (Cal.)