Terpenes, orange oil

Basic Information

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CAS Number

68647-72-3

Molecular Formula

C9H10N2S

Molecular Weight

178.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

176 °C

Density

0.84 g/mL at 25 °C

Refractive Index

n20/D 1.472(lit.)

SMILES

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S1C(C)=NC2C=C(C)C(=CC1=2)N

InChI

1S/C9H10N2S/c1-5-3-8-9(4-7(5)10)12-6(2)11-8/h3-4H,10H2,1-2H3

InChIKey

XZAPDJQMAHDLBL-UHFFFAOYSA-N

LogP

2.4953399999999997

Topological Polar Surface Area

38.91 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

174

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H304 May be fatal if swallowed and enters airways
Aspiration hazard

H315 Causes skin irritation
Skin corrosion/irritation

H317 May cause an allergic skin reaction
Sensitization, Skin

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Synonyms & References

English

CITRUS TERPENE
2,5-Dimethylbenzo[d]thiazol-6-amine
2,5-Dimethyl-6-benzothiazolamine
2,5-dimethyl-1,3-benzothiazol-6-amine
6-Benzothiazolamine, 2,5-dimethyl-
6-Benzothiazolamine,2,5-dimethyl-
2,5-dimethyl-1,3-benzothiazol-6-ylamine
6-BENZOTHIAZOLAMINE,2,5-DIMETHYL-(9CI)

FAQ

What is Terpenes, orange oil (CAS: 68647-72-3)?

Terpenes, orange oil (CAS: 68647-72-3) is a mixture of volatile organic compounds derived from citrus plants, primarily limonene. It is characterized by its distinctive orange scent and is known for its aromatic and flavor properties.

What are the main uses of Terpenes, orange oil (CAS: 68647-72-3)?

Terpenes, orange oil (CAS: 68647-72-3) is widely used in the food industry as a flavoring agent, in fragrances and perfumes for its citrus aroma, and in pharmaceuticals for its potential therapeutic properties.

Is Terpenes, orange oil (CAS: 68647-72-3) safe?

Terpenes, orange oil (CAS: 68647-72-3) is considered safe for use in food and cosmetics when used appropriately. However, excessive exposure can cause skin irritation or respiratory issues. Proper handling and storage are recommended to ensure safety.

How should Terpenes, orange oil (CAS: 68647-72-3) be stored?

Terpenes, orange oil (CAS: 68647-72-3) should be stored in a cool, dark place to prevent degradation. It should be kept in a tightly sealed container away from direct sunlight and high temperatures to maintain its quality and aroma.