(4-Chloro-5-Methyl-2-Nitrophenoxy)Acetic Acid
[CAS# 416885-45-5]

Identification

• Name: (4-Chloro-5-Methyl-2-Nitrophenoxy)Acetic Acid
• Synonyms: (4-chloro-5-methyl-2-nitrophenoxy)acetic acid; 2-(4-chloro-5-methyl-2-nitrophenoxy)acetic acid
• Molecular Formula: C₉H₈ClNO₅
• Molecular Weight: 245.62
• CAS Registry Number: 416885-45-5
• SMILES: Clc1cc(c(OCC(=O)O)cc1C)[N+]([O-])=O
• InChI: 1S/C9H8ClNO5/c1-5-2-8(16-4-9(12)13)7(11(14)15)3-6(5)10/h2-3H,4H2,1H3,(H,12,13)
• InChIKey: PQAJOTWEIQHUIQ-UHFFFAOYSA-N

Properties

• Density: 1.492g/cm³ (Cal.)
• Boiling point: 434.056°C at 760 mmHg (Cal.)
• Flash point: 216.31°C (Cal.)
• Refractive index: 1.588 (Cal.)