Heptyl Acetate

• CAS: 112-06-1
• Catalog Number: ACM112061
• Category: Other Products
• Molecular Weight: 158.2
• Molecular Formula: C9H18O2
• Description: Heptyl acetate has a pleasant odor suggestive of pear (rose) and a sweet, apricot-like taste.
• Synonyms: 1-Heptyl acetate
• IUPAC Name: heptyl acetate
• Canonical SMILES: CCCCCCCOC(=O)C
• InChI: InChI=1S/C9H18O2/c1-3-4-5-6-7-8-11-9(2)10/h3-8H2,1-2H3
• InChI Key: ZCZSIDMEHXZRLG-UHFFFAOYSA-N
• Boiling Point: 192-193℃
• Melting Point: -50°C
• Flash Point: 68.6°C
• Density: 0.87 g/cm³
• Solubility: water, 101.9 mg/L @ 25 °C (est)
• Appearance: Oil
• Assay: 0.99
• EC Number: 203-932-8
• MDL Number: MFCD00027311
• Packaging: 25 kg/DRUMS
• Physical State: Liquid
• Refractive Index: n20/D 1.414

Synthetic Use

Upstream Synthesis Route 1

• 463-51-4
• 111-70-6

• 112-06-1

Reference: [1]Ponomarew; Isaew
[Zhurnal Obshchei Khimii, 1951, vol. 21, p. 1045,1047,1048;engl.Ausg.S.1143,1145]

Upstream Synthesis Route 2

• 111-71-7
• 108-24-7

• 112-06-1

Reference: [1]Current Patent Assignee: L'AIR LIQUIDE - US2843607, 1954, A

Downstream Synthesis Route 1

• 112-06-1

• 592-76-7

Reference: [1]Geldof; Wibaut
[Recueil des Travaux Chimiques des Pays-Bas, 1948, vol. 67, p. 111]
van Pelt; Wibaut
[Recueil des Travaux Chimiques des Pays-Bas, 1941, vol. 60, p. 61]
Wibaut; van Pelt
[Recueil des Travaux Chimiques des Pays-Bas, 1938, vol. 57, p. 1058][Recueil des Travaux Chimiques des Pays-Bas, 1941, vol. 60, p. 61]

* For details of the synthesis route, please refer to the original source to ensure accuracy.