(1R,3S)-3-Ammonio-1-Phenylcyclopentanecarboxylate
[CAS# 325954-79-8]

Identification

• Name: (1R,3S)-3-Ammonio-1-Phenylcyclopentanecarboxylate
• Synonyms: (1R,3S)-3-amino-1-phenylcyclopentanecarboxylic acid; ZINC00759306
• Molecular Formula: C₁₂H₁₅NO₂
• Molecular Weight: 205.25
• CAS Registry Number: 325954-79-8
• SMILES: O=C([O-])[C@@]2(c1ccccc1)C[C@@H]([NH3+])CC2
• InChI: 1S/C12H15NO2/c13-10-6-7-12(8-10,11(14)15)9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,15)/t10-,12+/m0/s1
• InChIKey: SYYBCABUNCJCPM-CMPLNLGQSA-N

Properties

• Density: 1.199g/cm³ (Cal.)
• Boiling point: 374.145°C at 760 mmHg (Cal.)
• Flash point: 180.077°C (Cal.)
• Refractive index: 1.581 (Cal.)