Pentyl 4-Nitrobenzoate
[CAS# 14309-42-3]

Identification

• Name: Pentyl 4-Nitrobenzoate
• Synonyms: 4-Nitrobenzoic Acid Pentyl Ester; 4-Nitrobenzoic Acid Amyl Ester; Amyl P-Nitrobenzoate
• Molecular Formula: C₁₂H₁₅NO₄
• Molecular Weight: 237.25
• CAS Registry Number: 14309-42-3
• EINECS: 238-247-3
• SMILES: C1=C(C=CC(=C1)C(=O)OCCCCC)[N+]([O-])=O
• InChI: 1S/C12H15NO4/c1-2-3-4-9-17-12(14)10-5-7-11(8-6-10)13(15)16/h5-8H,2-4,9H2,1H3
• InChIKey: BFKGHSXQYBELBN-UHFFFAOYSA-N

Properties

• Density: 1.156g/cm³ (Cal.)
• Boiling point: 355.209°C at 760 mmHg (Cal.)
• Flash point: 149.286°C (Cal.)