Methyl Tridecanoate

• CAS: 1731-88-0
• Catalog Number: ACM1731880
• Category: Other Products; Fatty Acids and Ester Homologs
• Molecular Weight: 228.37
• Molecular Formula: C14H28O2
• Synonyms: Tridecanoic acid methyl ester
• IUPAC Name: methyl tridecanoate
• Canonical SMILES: CCCCCCCCCCCCC(=O)OC
• InChI Key: JNDDPBOKWCBQSM-UHFFFAOYSA-N
• Boiling Point: 163 °C
• Melting Point: 7 °C(lit.)
• Flash Point: 113 °C
• Density: 0.867 g/cm³
• Appearance: Liquid
• Storage: Room temperature
• CNo.Chain: C13:0
• Compound Derivative: Methyl
• EC Number: 217-054-8
• Exact Mass: 228.20900
• Fatty Acid: Tridecanoic
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Physical State: Liquid
• Refractive Index: 1.43
• Safety Description: 26-39
• WGK Germany: 3

Synthetic Use

Upstream Synthesis Route 1

• 908094-01-9
• 60488-42-8

• 1731-88-0

Reference: [1]Achenbach,H. et al.
[Chemische Berichte, 1976, vol. 109, p. 2490 - 2502]

Upstream Synthesis Route 2

• 186581-53-3
• 638-53-9

• 1731-88-0

Reference: [1]Tetrahedron,1985,vol. 41,p. 4213 - 4236
[2]Petroleum Chemistry,2010,vol. 50,p. 442 - 449

Upstream Synthesis Route 3

• 67-56-1
• 112-41-4
• 201230-82-2

• 1731-88-0
• 149948-76-5

Reference: [1]Toda, Shiho; Miyamoto, Masanori; Kinoshita, Hideki; Inomata, Katsuhiko
[Bulletin of the Chemical Society of Japan, 1991, vol. 64, # 12, p. 3600 - 3606]