(2E)-3-(2,5-Dimethylphenyl)acrylic acid
[CAS# 95883-10-6]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Aromatic cinnamic acid, esters and derivatives
• Name: (2E)-3-(2,5-Dimethylphenyl)acrylic acid
• Synonyms: (2E)-3-(2,5-dimethylphenyl)prop-2-enoic acid; 2,5-DIMETHYLCINNAMIC ACID; 2,5-DIMETHYLCINNAMICACID
• Molecular Formula: C₁₁H₁₂O₂
• Molecular Weight: 176.21
• CAS Registry Number: 95883-10-6
• SMILES: CC1=CC(=C(C=C1)C)/C=C/C(=O)O
• InChI: 1S/C11H12O2/c1-8-3-4-9(2)10(7-8)5-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-5+
• InChIKey: FAIBVLSPNAHVSQ-AATRIKPKSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Melting point: 129-131°C (Expl.)
• Boiling point: 307.0±11.0°C at 760 mmHg (Cal.)
• Flash point: 212.2±10.2°C (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Irritates lungs, eyes, skin