Ethyl (1R,2R)-2-Isothiocyanatocyclopentanecarboxylate
[CAS# 311341-95-4]

Identification

• Name: Ethyl (1R,2R)-2-Isothiocyanatocyclopentanecarboxylate
• Synonyms: (1R,2R)-ethyl 2-isothiocyanatocyclopentanecarboxylate
• Molecular Formula: C₉H₁₃NO₂S
• Molecular Weight: 199.27
• CAS Registry Number: 311341-95-4
• SMILES: S=C=N/[C@@H]1CCC[C@H]1C(=O)OCC
• InChI: 1S/C9H13NO2S/c1-2-12-9(11)7-4-3-5-8(7)10-6-13/h7-8H,2-5H2,1H3/t7-,8-/m1/s1
• InChIKey: IDCQKRRLLDGLAD-HTQZYQBOSA-N

Properties

• Density: 1.206g/cm³ (Cal.)
• Boiling point: 292.171°C at 760 mmHg (Cal.)
• Flash point: 130.501°C (Cal.)
• Refractive index: 1.566 (Cal.)