Isopropyl 4-Chlorobenzoate
[CAS# 22913-11-7]

Identification

• Name: Isopropyl 4-Chlorobenzoate
• Synonyms: 4-Chlorobenzoic acid, isopropyl ester; Benzoic acid, 4-chloro, isopropyl ester; Benzoicacid,4-chloro-,1-methylethylester
• Molecular Formula: C₁₀H₁₁ClO₂
• Molecular Weight: 198.65
• CAS Registry Number: 22913-11-7
• SMILES: O=C(OC(C)C)c1ccc(Cl)cc1
• InChI: 1S/C10H11ClO2/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7H,1-2H3
• InChIKey: VOLPFZRDHTWKTD-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 249.89°C at 760 mmHg (Cal.)
• Flash point: 112.084°C (Cal.)
• Refractive index: 1.516 (Cal.)