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

Basic Information

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CAS Number

67715-80-4

Molecular Formula

C8H16OS

Molecular Weight

160.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

218-220 ºC

Density

0.975

Flash Point

50 ºC

Refractive Index

1.4800

SMILES

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CCCC1CCOC(S1)C

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

LogP

2.654600000000001

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

95.3

Safety Information

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GHS Hazard Pictograms

H226

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

Hazard Class

Class 3 Class 3

Synonyms & References

English

2-Methyl-4-propyl-1,3-oxathiane
2-Methyl-4-n-propyl-1,3-oxathiane
2-Methyl-4-propyl-1,3-oxathiane (cis- and trans- mixture)
1,3-Oxathiane,2-methyl-4-propyl
2-Methyl-4-n-propyl-1,3-oxathiane,cis + trans
2-METHYL-4-PROPYL-1,3-OXATHIANE,NATURAL
2-METHYL-4-PROPYL-1,3-OXATHIANE,TECH GRADE
FEMA 3578
TROPATHIANE
1,3-Oxathiane, 2-methyl-4-propyl-
cis-2-Methyl-4-propyl-1,3-oxathiane
2-Methyl-4-propyl-1,3-oxathiane, mixture of cis and trans
trans-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-
C8H16OS
2-tropical oxathiane
(E)-galbanum oxathiane
(Z)-galbanum oxathiane
DSSTox_RID_82512
DSSTox_CID_27704
DSSTox_GSID_47706

MDL Number

MFCD00673203

Customs Code

2934999090

FAQ

What is 2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4)?

2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) is a cyclic sulfur compound with the molecular formula C7H14O2S. It is characterized by its distinctive odor and is used in various applications, including pharmaceuticals and fragrances.

What are the main uses of 2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4)?

2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) is primarily used in the pharmaceutical industry as a raw material for drug synthesis and as a fragrance component in perfumes and cosmetics. It is also utilized in research and as a solvent in certain chemical processes.

Is 2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) safe?

2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) is generally safe when handled properly. Users should wear appropriate personal protective equipment, such as gloves and protective eyewear. Avoid contact with skin and eyes, and ensure good ventilation during use.

How should 2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) be stored?

2-Methyl-4-propyl-1,3-oxathiane (CAS: 67715-80-4) should be stored in a cool, dry place away from direct sunlight and heat sources. Store in a closed container to prevent evaporation and contamination. Keep it away from incompatible materials such as strong acids and oxidizers.