Fenitropan
[CAS# 65934-95-4]

Identification

• Name: Fenitropan
• Synonyms: [(2R,3S)-3-Acetoxy-2-Nitro-3-Phenyl-Propyl] Acetate; Acetic Acid [(2R,3S)-3-Acetoxy-2-Nitro-3-Phenylpropyl] Ester; Acetic Acid [(2R,3S)-3-Acetoxy-2-Nitro-3-Phenyl-Propyl] Ester
• Molecular Formula: C₁₃H₁₅NO₆
• Molecular Weight: 281.26
• CAS Registry Number: 65934-95-4
• SMILES: [C@@H](OC(=O)C)([C@H]([N+]([O-])=O)COC(=O)C)C1=CC=CC=C1
• InChI: 1S/C13H15NO6/c1-9(15)19-8-12(14(17)18)13(20-10(2)16)11-6-4-3-5-7-11/h3-7,12-13H,8H2,1-2H3/t12-,13+/m1/s1
• InChIKey: AYBALPYBYZFKDS-OLZOCXBDSA-N

Properties

• Density: 1.246g/cm³ (Cal.)
• Boiling point: 392.278°C at 760 mmHg (Cal.)
• Flash point: 161.334°C (Cal.)