(1R,3S)-3-[2-(3-Nitrophenyl)-2-oxoethyl]cyclopentanecarboxylic acid
[CAS# 733740-49-3]

Identification

• Name: (1R,3S)-3-[2-(3-Nitrophenyl)-2-oxoethyl]cyclopentanecarboxylic acid
• Synonyms: cis-3-[2-oxo-2-(3-nitrophenyl)ethyl]cyclopentane-1-carboxylic acid
• Molecular Formula: C₁₄H₁₅NO₅
• Molecular Weight: 277.27
• CAS Registry Number: 733740-49-3
• SMILES: O=C(O)[C@H]2C[C@@H](CC(=O)c1cccc(c1)[N+]([O-])=O)CC2
• InChI: 1S/C14H15NO5/c16-13(7-9-4-5-11(6-9)14(17)18)10-2-1-3-12(8-10)15(19)20/h1-3,8-9,11H,4-7H2,(H,17,18)/t9-,11+/m0/s1
• InChIKey: UMSKLRUILBBSKW-GXSJLCMTSA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Boiling point: 445.601°C at 760 mmHg (Cal.)
• Flash point: 186.033°C (Cal.)
• Refractive index: 1.581 (Cal.)