(2S,5R)-1-(Chloroacetyl)-5-ethynyl-2-pyrrolidinecarbonitrile
[CAS# 676559-69-6]

Identification

• Name: (2S,5R)-1-(Chloroacetyl)-5-ethynyl-2-pyrrolidinecarbonitrile
• Synonyms: (2S,5R)-1-(2-chloroacetyl)-5-ethynylpyrrolidine-2-carbonitrile
• Molecular Formula: C₉H₉ClN₂O
• Molecular Weight: 196.63
• CAS Registry Number: 676559-69-6
• SMILES: N#C[C@H]1N(C(=O)CCl)[C@@H](C#C)CC1
• InChI: 1S/C9H9ClN2O/c1-2-7-3-4-8(6-11)12(7)9(13)5-10/h1,7-8H,3-5H2/t7-,8-/m0/s1
• InChIKey: OSBIHDNHTGLZIU-YUMQZZPRSA-N

Properties

• Density: 1.276g/cm³ (Cal.)
• Boiling point: 373.504°C at 760 mmHg (Cal.)
• Flash point: 179.689°C (Cal.)
• Refractive index: 1.538 (Cal.)