beta-Methyl-4-Nitrohydrocinnamic Acid Methyl Ester
[CAS# 24254-61-3]

Identification

• Name: beta-Methyl-4-Nitrohydrocinnamic Acid Methyl Ester
• Synonyms: 3-(4-Nitrophenyl)Butanoic Acid Methyl Ester; 3-(4-Nitrophenyl)Butyric Acid Methyl Ester; Hydrocinnamic Acid, .Beta.-Methyl-P-Nitro-, Methyl Ester
• Molecular Formula: C₁₁H₁₃NO₄
• Molecular Weight: 223.23
• CAS Registry Number: 24254-61-3
• SMILES: C1=C(C(CC(OC)=O)C)C=CC(=C1)[N+]([O-])=O
• InChI: 1S/C11H13NO4/c1-8(7-11(13)16-2)9-3-5-10(6-4-9)12(14)15/h3-6,8H,7H2,1-2H3
• InChIKey: LGXBWSXGLXOQDJ-UHFFFAOYSA-N

Properties

• Density: 1.188g/cm³ (Cal.)
• Boiling point: 322.712°C at 760 mmHg (Cal.)
• Flash point: 135.862°C (Cal.)