2-Methyl-4-propyl-1,3-oxathiane CAS 67715-80-4

Introduction：Basic information about 2-Methyl-4-propyl-1,3-oxathiane CAS 67715-80-4, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

2-Methyl-4-propyl-1,3-oxathiane Basic information

• Product Name: 2-Methyl-4-propyl-1,3-oxathiane
• Synonyms: 2-METHYL-4-PROPYL-1,3-OXATHIANE;2-METHYL-4-N-PROPYL-1,3-OXATHIANE;FEMA 3578;TROPATHIANE;2-Methyl-4-n-propyl-1,3-oxathiane, cis + trans, 99%;1,3-Oxathiane, 2-methyl-4-propyl-;2-METHYL-4-PROPYL-1,3-OXATHIANE 0.1% IN PG, NATURAL;2-METHYL-4-PROPYL-1,3-OXATHIANE 1% IN ETHANOL, NATURAL
• CAS: 67715-80-4
• MF: C8H16OS
• MW: 160.28
• EINECS: 000-000-0
• Product Categories: Alphabetical Listings;Flavors and Fragrances;M-N;Flavor
• Mol File: 67715-80-4.mol

2-Methyl-4-propyl-1,3-oxathiane Chemical Properties

• Boiling point: 218-220 °C (lit.)
• density: 0.975 g/mL at 25 °C (lit.)
• FEMA: 3578 | 2-METHYL-4-PROPYL-1,3-OXATHIANE
• refractive index: 1.4800
• Fp: 50 °C
• storage temp.: 2-8°C
• form: clear liquid
• color: Colorless to Yellow to Orange
• Odor: at 1.00 % in dipropylene glycol. green tropical galbanum pineapple
• Odor Type: tropical
• biological source: synthetic
• JECFA Number: 464
• Major Application: flavors and fragrances
• InChI: InChI=1S/C8H16OS/c1-3-4-8-5-6-9-7(2)10-8/h7-8H,3-6H2,1-2H3
• InChIKey: GKGOLPMYJJXRGD-UHFFFAOYSA-N
• SMILES: O1CCC(CCC)SC1C
• LogP: 2.31
• CAS DataBase Reference: 67715-80-4(CAS DataBase Reference)

Safety Information

• Risk Statements: 10
• Safety Statements: 3/7-15-36-3/9/49-29/56
• RIDADR: UN 1993
• WGK Germany: 3
• HazardClass: 3
• PackingGroup: III
• HS Code: 29349990
• Storage Class: 3 - Flammable liquids
• Hazard Classifications: Flam. Liq. 3

2-Methyl-4-propyl-1,3-oxathiane Usage And Synthesis

Chemical Properties

Colorless liquid

Occurrence

Reported found in passion fruit.

Uses

flavors and fragrances

Definition

ChEBI: 2-methyl-4-propyl-1,3-oxathiane is an organosulfur heterocyclic compound and an oxacycle that is 1,3-oxathiane substituted by a methyl group at position 2 and a propyl group at position 4 respectively. It has a role as a metabolite. It is an organosulfur heterocyclic compound and an oxacycle.

Aroma threshold values

Detection: 2 to 4 ppb. Aroma characteristics at 1.0%: bright impacting sulfury, catty, green alliaceousvegetative, tropical, oil, grapefruit, ripe fruity, reminiscent of pulpy mango and peach.

Taste threshold values

Taste characteristics at 2 ppm: sulfurous, pulpy tropical passion fruit and durian, oily green waxy, citruslike,gooseberry-like, ripe fresh pineapple with a rootlike radish nuance.

General Description

2-Methyl-4-propyl-1,3-oxathiane (mixture of cis and trans) is the key sulfur-containing aroma and flavor compound of yellow passion fruit.