| Identification | More | [Name]
2-Methyl-4-propyl-1,3-oxathiane | [CAS]
67715-80-4 | [Synonyms]
2-METHYL-4-N-PROPYL-1,3-OXATHIANE
2-METHYL-4-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
2-METHYL-4-PROPYL-1,3-OXATHIANE 10% IN ETHANOL, NATURAL
2-METHYL-4-PROPYL-1,3-OXATHIANE, NATURAL
2-METHYL-4-PROPYL-1,3-OXATHIANE, TECH GRADE
2-Methyl-4-propyl-1,3-oxathiane (cis-and trans-mixture) | [EINECS(EC#)]
-0 | [Molecular Formula]
C8H16OS | [MDL Number]
MFCD00673203 | [Molecular Weight]
160.28 | [MOL File]
67715-80-4.mol |
| Chemical Properties | Back Directory | [Boiling point ]
218-220 °C (lit.) | [density ]
0.975 | [FEMA ]
3578 | [refractive index ]
1.4800 | [Fp ]
50 °C | [storage temp. ]
Sealed in dry,2-8°C | [form ]
clear liquid | [color ]
Colorless to Yellow to Orange | [Odor]
at 1.00 % in dipropylene glycol. green tropical galbanum pineapple | [biological source]
synthetic | [Odor Type]
tropical | [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 Data | Back Directory | [Risk Statements ]
R10:Flammable. | [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 |
| Hazard Information | Back Directory | [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 alliaceous
vegetative, 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. |
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