(2R,3R)-2-Cyano-3-Isopropyl-2-Oxiranecarboxylic Acid
[CAS# 113966-59-9]

Identification

• Name: (2R,3R)-2-Cyano-3-Isopropyl-2-Oxiranecarboxylic Acid
• Synonyms: (2R,3R)-2-cyano-3-isopropyloxirane-2-carboxylic acid
• Molecular Formula: C₇H₉NO₃
• Molecular Weight: 155.15
• CAS Registry Number: 113966-59-9
• SMILES: CC(C)[C@@H]1[C@](O1)(C#N)C(=O)O
• InChI: 1S/C7H9NO3/c1-4(2)5-7(3-8,11-5)6(9)10/h4-5H,1-2H3,(H,9,10)/t5-,7-/m1/s1
• InChIKey: BHJYCNGGHQNYBZ-IYSWYEEDSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 338.9±42.0°C at 760 mmHg (Cal.)
• Flash point: 158.8±27.9°C (Cal.)
• Refractive index: 1.495 (Cal.)