3-Chloro-4-Hydroxybenzoic Acid 4-Pentylphenyl Ester
[CAS# 50687-70-2]

Identification

• Name: 3-Chloro-4-Hydroxybenzoic Acid 4-Pentylphenyl Ester
• Synonyms: (4-Pentylphenyl) 3-Chloro-4-Hydroxy-Benzoate; 3-Chloro-4-Hydroxybenzoic Acid (4-Pentylphenyl) Ester; 3-Chloro-4-Hydroxy-Benzoic Acid (4-Amylphenyl) Ester
• Molecular Formula: C₁₈H₁₉ClO₃
• Molecular Weight: 318.80
• CAS Registry Number: 50687-70-2
• SMILES: C1=C(C(=CC(=C1)C(=O)OC2=CC=C(C=C2)CCCCC)Cl)O
• InChI: 1S/C18H19ClO3/c1-2-3-4-5-13-6-9-15(10-7-13)22-18(21)14-8-11-17(20)16(19)12-14/h6-12,20H,2-5H2,1H3
• InChIKey: MBWAFEFPEJYWGU-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)
• Boiling point: 462.757°C at 760 mmHg (Cal.)
• Flash point: 233.667°C (Cal.)