12-Tridecenoic acid methyl ester
[CAS# 29780-00-5]

Identification

• Classification: Analytical chemistry >> Food safety >> Fatty acid, fatty acid methyl ester
• Name: 12-Tridecenoic acid methyl ester
• Synonyms: Tridec-12-Enoic Acid Methyl Ester; Nsc159260
• Molecular Formula: C₁₄H₂₆O₂
• Molecular Weight: 226.36
• CAS Registry Number: 29780-00-5
• SMILES: C(CCC(OC)=O)CCCCCCCC=C
• InChI: 1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-14(15)16-2/h3H,1,4-13H2,2H3
• InChIKey: LCAVRNOMCURXMM-UHFFFAOYSA-N

Properties

• Density: 0.877g/cm³ (Cal.)
• Boiling point: 279.269°C at 760 mmHg (Cal.)
• Flash point: 116.131°C (Cal.)