2-Methyl-4-propyl-1,3-oxathiane CAS#: 67715-80-4; ChemWhat Code: 36573

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

Product Name2-Methyl-4-propyl-1,3-oxathiane
IUPAC Name2-methyl-4-propyl-1,3-oxathiane
Molecular StructureStructure-of-2-Methyl-4-propyl-13-oxathiane-CAS-67715-80-4
CAS Registry Number 67715-80-4
MDL NumberMFCD00673203
Synonyms2-methyl-4-propyl-1,3-oxathiane
2-Methyl-4-propyl-1,3-oxathiane; 1,3-Oxathiane, 2-methyl-4-propyl-; CHEBI:87335; cis-2-Methyl-4-propyl-1,3-oxathiane; 1,3-Oxathiane, 2-methyl-4-propyl-, (2R,4R)-rel-; 1,3-Oxathiane, 2-methyl-4-propyl-, (2R,4S)-rel-; Tropathiane; C8H16OS; 2-tropical oxathiane; (E)-galbanum oxathiane; (Z)-galbanum oxathiane; DSSTox_CID_27704; DSSTox_RID_82512; DSSTox_GSID_47706; KSC491C9B; SCHEMBL238101; CHEMBL3183970; DTXSID9047706; CTK3J1190; FEMA 3578; GKGOLPMYJJXRGD-UHFFFAOYSA-N; 2-Methyl-4-propyl-1,3-oxathiane, mixture of cis and trans; Tox21_303625; ANW-42046; MFCD00673203; SBB058540; AKOS015897607; 2-Methyl-4-propyl-cis-1,3-Oxathiane; FCH1118874; MCULE-3956541978; KS-0000112P; 2-Methyl-4-propyl-trans-1,3-Oxathiane; cis-2-Methyl-4-propyl-1,3-oxathiane.; NCGC00256774-01; U226; CAS-67715-80-4; 2-METHYL-4-N-PROPYL-1,3-OXATHIANE; FT-0605365; FT-0657874; FT-0699681; M2049; ST50407316; 2-Methyl-4-propyl-(2R,4R)-rel-1,3-Oxathiane; 2-Methyl-4-propyl-(2R,4S)-rel-1,3-Oxathiane; J-640461; J-800468; Q27159538; 2-Methyl-4-propyl-1,3-oxathiane, mixture of cis and trans, >=98, FG; 2-methyl-4-propyl-1,3-oxathiane;CAS 67715-80-4
Molecular FormulaC8H16OS
Molecular Weight160.28
InChIInChI=1S/C8H16OS/c1-3-4-8-5-6-9-7(2)10-8/h7-8H,3-6H2,1-2H3
InChI KeyGKGOLPMYJJXRGD-UHFFFAOYSA-N
Canonical SMILESCCCC1CCOC(S1)C
Patent Information
No data available

Physical Data

AppearanceColorless to yellow liquid
SolubilityIt is soluble in water as well as soluble in alcohol, benzene.
Flash Point88 oC
Refractive index1.5560 (estimate)
SensitivityAir Sensitive & Hygroscopic
Boiling Point, °C
218~220°C

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

Pictogram(s)flame
SignalWarning
GHS Hazard StatementsH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Information may vary between notifications depending on impurities, additives, and other factors.
Precautionary Statement CodesP210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501
(The corresponding statement to each P-code can be found at the?GHS Classification?page.)
For more detailed information, please visit?ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationClass 3; Packaging Group: III; UN Number: 1993C
Under the room temperature and away from light
HS Code293499
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD
Use Pattern
Often added as a flavor and fragrance in food.

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