Grapefruit oil

Basic Information

View in Editor

CAS Number

8016-20-4

Molecular Formula

C14H18O3

Molecular Weight

234.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

171 °C

Density

0.85 g/mL at 25 °C

Refractive Index

n20/D 1.475

SMILES

View in Editor

O(CC)C(C(C1C=CC(=CC=1)C(C)(C)C)=O)=O

InChI

1S/C14H18O3/c1-5-17-13(16)12(15)10-6-8-11(9-7-10)14(2,3)4/h6-9H,5H2,1-4H3

InChIKey

VQDPLASXAHWKJX-UHFFFAOYSA-N

LogP

2.7299000000000007

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

280

Safety Information

View Safety Information

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 3.2 Class 3.2

Synonyms & References

English

Grapefruit Oil
GRAPEFRUIT OIL(RG)
Oil of grapefruit
Citrus paradisi oil
Citrus paradisi peel oil
Coldpressed grapefruit oil
FEMA No. 2530
Grapefruit oil, coldpressed
Grapefruit oil, expressed
Grapefruit oil, expressed (Citrus paradisi Macf.)
HSDB 1924
Oils, grapefruit
Toronja
Ethyl 4-tert-butylbenzoylformate
ethyl 2-(4-tert-butylphenyl)-2-oxoacetate
ethyl 2-(4-tert-butylphenyl)glyoxylate
ethyl (4-tert-butylphenyl)(oxo)acetate
Benzeneacetic acid,4-(1,1-dimethylethyl)-
A-oxo-, ethyl ester
(4-tert-butylphenyl)glyoxylic acid ethyl ester
9930AE
NE59213
Ethyl 4-tert-butylbenzoylformate, AldrichCPR
(4-tert-butylphenyl)oxoacetic acid ethyl ester
Ethyl

FAQ

What is Grapefruit oil (CAS: 8016-20-4)?

Grapefruit oil (CAS: 8016-20-4) is a naturally derived essential oil extracted from the peel of the grapefruit (Citrus paradisi). It has a citrusy, fresh aroma and is characterized by its high content of d-limonene. Common properties include its anti-inflammatory and antioxidant effects.

What are the main uses of Grapefruit oil (CAS: 8016-20-4)?

Grapefruit oil (CAS: 8016-20-4) is widely used in the fragrance industry for perfumes and cosmetics. It is also utilized in aromatherapy for stress relief and mood enhancement. In the food industry, it serves as a flavoring agent, and in pharmaceuticals, it is used for its potential skin care and antifungal properties.

Is Grapefruit oil (CAS: 8016-20-4) safe?

Grapefruit oil (CAS: 8016-20-4) is considered safe when used in appropriate concentrations and under professional guidance. However, it should be used with caution as it can cause phototoxic reactions. Protective measures include avoiding direct sunlight after application and diluting before topical use.

How should Grapefruit oil (CAS: 8016-20-4) be stored?

Grapefruit oil (CAS: 8016-20-4) should be stored in a cool, dark place to preserve its quality. It should be kept away from direct sunlight and high temperatures to prevent degradation. The container should be tightly sealed to maintain its volatile compounds. Keep out of reach of children and pets and store in a secure location.