5-(5-Chloro-2-Methoxyphenyl)-5-Oxopentanoic Acid
[CAS# 162930-56-5]

Identification

• Name: 5-(5-Chloro-2-Methoxyphenyl)-5-Oxopentanoic Acid
• Synonyms: 5-(5-Chloro-2-methoxyphenyl)-5-oxovaleric acid
• Molecular Formula: C₁₂H₁₃ClO₄
• Molecular Weight: 256.68
• CAS Registry Number: 162930-56-5
• SMILES: Clc1cc(c(OC)cc1)C(=O)CCCC(=O)O
• InChI: 1S/C12H13ClO4/c1-17-11-6-5-8(13)7-9(11)10(14)3-2-4-12(15)16/h5-7H,2-4H2,1H3,(H,15,16)
• InChIKey: MQWKMHFRUKBXQO-UHFFFAOYSA-N

Properties

• Density: 1.277g/cm³ (Cal.)
• Boiling point: 455°C at 760 mmHg (Cal.)
• Flash point: 228.976°C (Cal.)
• Refractive index: 1.542 (Cal.)