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1516-17-2

1516-17-2 Structure

1516-17-2 Structure
IdentificationMore
[Name]

TRANS,TRANS-2,4-HEXADIENYL ACETATE
[CAS]

1516-17-2
[Synonyms]

2,4-HEXADIENYL ACETATE
SORBYL ACETATE
T2 T4 HEXADIEN 1YL ACETATE
TRANS,TRANS-2,4-HEXADIENYL ACETATE
2,4-hexadien-1-ol,acetate
2,4-hexadienylesterkyselinyoctove
aceticacid,2,4-hexadien-1-olester
aceticacid,2,4-hexadienylester
hexa-2,4-dienyl acetate
TRANS,TRANS-2,4-HEXADIEN-1-YL ACETATE
2,4-Hexad
1-Acetoxy-2,4-hexadiene
[EINECS(EC#)]

216-163-8
[Molecular Formula]

C8H12O2
[MDL Number]

MFCD00036521
[Molecular Weight]

140.18
[MOL File]

1516-17-2.mol
Chemical PropertiesBack Directory
[Boiling point ]

192-193 °C (lit.)
[density ]

0.939 g/mL at 25 °C(lit.)
[FEMA ]

4132
[refractive index ]

n20/D 1.474(lit.)
[Fp ]

182 °F
[storage temp. ]

Sealed in dry,Room Temperature
[Odor]

Fragrance
[Odor Type]

green
[Water Solubility ]

Insoluble in water.
[JECFA Number]

1780
[BRN ]

1702607
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

InChI=1S/C8H12O2/c1-3-4-5-6-7-10-8(2)9/h3-6H,7H2,1-2H3
[InChIKey]

PXVKYPFROMBALG-UHFFFAOYSA-N
[SMILES]

C(OC(=O)C)C=CC=CC
[LogP]

1.91
[CAS DataBase Reference]

1516-17-2(CAS DataBase Reference)
[EPA Substance Registry System]

2,4-Hexadien-1-ol, acetate (1516-17-2)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R41:Risk of serious damage to eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S39:Wear eye/face protection .
[WGK Germany ]

3
[RTECS ]

AI0350000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29153900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Dam. 1
[Toxicity]

LD50 orl-rat: 4360 mL/kg TXAPA9 28,313,74
Hazard InformationBack Directory
[Chemical Properties]

Colorless liquid; powerful, sweet, pineapple aroma
[Definition]

ChEBI: 2,4-Hexadienyl acetate is a carboxylic ester.
[Aroma threshold values]

Medium strength odor, green type.
[Taste threshold values]

Fresh green herbal soapy metallic taste at 25 ppm in water.
[Safety Profile]

Moderately toxic by ingestion andskin contact. A skin and severe eye irritant.
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

trans,trans-2,4-Hexadienyl acetate, 97%(1516-17-2)
[Sigma Aldrich]

1516-17-2(sigmaaldrich)
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