5-Decoxycarbonyl-2-Octoxycarbonylbenzoic Acid
[CAS# 34870-88-7]

Identification

• Name: 5-Decoxycarbonyl-2-Octoxycarbonylbenzoic Acid
• Synonyms: 5-Decoxycarbonyl-2-Octoxycarbonyl-Benzoic Acid; 5-(Decoxy-Oxomethyl)-2-(Octoxy-Oxomethyl)Benzoic Acid
• Molecular Formula: C₂₇H₄₂O₆
• Molecular Weight: 462.63
• CAS Registry Number: 34870-88-7
• EINECS: 252-262-2
• SMILES: C1=C(C=CC(=C1C(=O)O)C(=O)OCCCCCCCC)C(=O)OCCCCCCCCCC
• InChI: 1S/C27H42O6/c1-3-5-7-9-11-12-14-15-19-32-26(30)22-17-18-23(24(21-22)25(28)29)27(31)33-20-16-13-10-8-6-4-2/h17-18,21H,3-16,19-20H2,1-2H3,(H,28,29)
• InChIKey: SPJSLCOGEQKNOP-UHFFFAOYSA-N

Properties

• Density: 1.047g/cm³ (Cal.)
• Boiling point: 583.25°C at 760 mmHg (Cal.)
• Flash point: 183.075°C (Cal.)