ChemicalBook--->CAS DataBase List--->7493-74-5

7493-74-5

7493-74-5 Structure

7493-74-5 Structure
IdentificationMore
[Name]

Allyl phenoxyacetate
[CAS]

7493-74-5
[Synonyms]

2-PROPENYLPHENOXYACETATE
ACETATE PA
ALLYL PHENOXYACETATE
FEMA 2038
Acetic acid, phenoxy-, 2-propenyl ester
Acetic acid, phenoxy-, allyl ester
Aceticacid,phenoxy-,2-propenylester
phenoxy-aceticaci2-propenylester
phenoxy-aceticaciallylester
ALLYL PHENOXYACETATE 99+%
Allylphenoxyacetat
KAMILLENESTER
Phenoxyacetic Acid Allyl Ester
Prop-2-enyl 2-(phenoxy)acetate
ALLYL PHENOXYACETATE, 98+%
[EINECS(EC#)]

231-335-2
[Molecular Formula]

C11H12O3
[MDL Number]

MFCD00044632
[Molecular Weight]

192.21
[MOL File]

7493-74-5.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS TO SLIGHTLY YELLOW LIQUID
[Boiling point ]

265-266 °C(lit.)
[density ]

1.102 g/mL at 25 °C(lit.)
[vapor pressure ]

7Pa at 20℃
[FEMA ]

2038
[refractive index ]

n20/D 1.516(lit.)
[Fp ]

>230 °F
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

neat
[color ]

Colorless to Almost colorless
[Odor]

at 100.00 %. sweet fresh honey pineapple chamomile cocoa
[biological source]

synthetic
[Odor Type]

fruity
[Water Solubility ]

practically insoluble
[JECFA Number]

18
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C11H12O3/c1-2-8-13-11(12)9-14-10-6-4-3-5-7-10/h2-7H,1,8-9H2
[InChIKey]

VUFZVGQUAVDKMC-UHFFFAOYSA-N
[SMILES]

C=CCOC(=O)COc1ccccc1
[LogP]

2.33 at 24.7℃
[Uses]

Allyl Phenoxyacetate is a synthetic flavoring agent that is a stable, colorless to light yellow liquid of heavy fruit note odor. it should be stored in glass or tin containers. it is used in pineapple, quince, and fruit flavors with applications in candy and beverages at 1–3 ppm.
[CAS DataBase Reference]

7493-74-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Allyl phenoxyacetate(7493-74-5)
[EPA Substance Registry System]

7493-74-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36:Wear suitable protective clothing .
S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN 2810 6.1/PG 3
[WGK Germany ]

1
[RTECS ]

AJ2240000
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29189900
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Acute 1
Skin Sens. 1B
[Safety Profile]

Moderately toxic by ingestion and skin contact. When heated to decomposition it emits acrid smoke and irritating fumes. See also ALLK COMPOUNDS.
[Toxicity]

The acute oral LD50 value in rats was reported as 0.475 ml/kg . The acute dermal LD50 in rabbits was reported as 0.82 ml/kg.
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Allyl alcohol-->Phenoxyacetic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Allyl phenoxyacetate(7493-74-5).msds
Hazard InformationBack Directory
[Chemical Properties]

Allyl phenoxyacetate is a clear, colorless to yellowish liquid with a green, sweet, herbal, fruity odor with nuances of galbanum and pineapple.
It is prepared by reaction of phenoxyacetic acid alkali salts with allyl halogenide and used in technical perfumery.
[Occurrence]

Has apparently not been reported to occur in nature.
[Definition]

ChEBI:Allyl phenoxyacetate is a monocarboxylic acid.
[Preparation]

By direct esterification in benzene solution.
[Production Methods]

Allyl phenoxyacetate can be producted by direct esterification of Allyl alcohol with Phenoxy acetic acid under azeotropic conditions.
[Flammability and Explosibility]

Notclassified
Questions And AnswerBack Directory
[Aroma]

Somewhat sharp, mixed-fruity, mainly Pineapple-like and honey-sweet odor of great tenacity. Heavy-sweet fruity-honey-like taste, somewhat reminiscent of "cooked" fruit.
Rarely, if ever, used in perfumery, except for "honey" bases, etc. Used in flavor compositions, as a modifier in imitation Strawberry, Pineapple, etc. in mere traces.
Spectrum DetailBack Directory
[Spectrum Detail]

Allyl phenoxyacetate(7493-74-5)1HNMR
Allyl phenoxyacetate(7493-74-5)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Allyl phenoxyacetate, 98+%(7493-74-5)
[Sigma Aldrich]

7493-74-5(sigmaaldrich)
[TCI AMERICA]

Allyl Phenoxyacetate,>98.0%(GC)(7493-74-5)
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