1-[(3-Fluorobenzoyl)amino]cycloheptanecarboxylic acid
[CAS# 912771-18-7]

Identification

• Name: 1-[(3-Fluorobenzoyl)amino]cycloheptanecarboxylic acid
• Synonyms: 1-(3-Fluoro-benzoylamino)-cycloheptanecarboxylic acid; 1-[(3-fluorobenzene)amido]cycloheptane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₈FNO₃
• Molecular Weight: 279.31
• CAS Registry Number: 912771-18-7
• SMILES: c1cc(cc(c1)F)C(=O)NC2(CCCCCC2)C(=O)O
• InChI: 1S/C15H18FNO3/c16-12-7-5-6-11(10-12)13(18)17-15(14(19)20)8-3-1-2-4-9-15/h5-7,10H,1-4,8-9H2,(H,17,18)(H,19,20)
• InChIKey: CYOXXKKBLPKXAR-UHFFFAOYSA-N

Properties

• Density: 1.251g/cm³ (Cal.)
• Boiling point: 474.103°C at 760 mmHg (Cal.)
• Flash point: 240.529°C (Cal.)
• Refractive index: 1.557 (Cal.)