(2E)-3,7-Dimethyl-2,6-Octadienoic Acid
[CAS# 4613-38-1]

Identification

• Name: (2E)-3,7-Dimethyl-2,6-Octadienoic Acid
• Synonyms: (2E)-3,7-Dimethyl-2,6-octadienoic acid #; (2Z)-3,7-Dimethyl-2,6-octadienoic acid; (E)-3,7-dimethylocta-2,6-dienoic acid
• Molecular Formula: C₁₀H₁₆O₂
• Molecular Weight: 168.23
• CAS Registry Number: 4613-38-1
• SMILES: CC(=CCC/C(=C/C(=O)O)/C)C
• InChI: 1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7+
• InChIKey: ZHYZQXUYZJNEHD-VQHVLOKHSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 295.3±19.0°C at 760 mmHg (Cal.)
• Flash point: 133°C (Expl.)

Safety Data

• Safety Code: S26;S36/37
• Risk Code: R21;R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Harmful through skin absorbtion or ingestion.