Hexyl octanoate supplier | CasNO.1117-55-1

Name
FEMA 2575
EINECS
CAS No. 1117-55-1
Article Data10
CAS DataBase
Density 0.867g/cm³
Solubility
Melting Point -30.6°C
Formula C14H28 O2
Boiling Point 274.7°Cat760mmHg
Molecular Weight 228.375
Flash Point 120°C
Transport Information
Appearance
Safety Mildly toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hexylcaprylate; Hexyl octanoate; n-Hexyl caprylate
PSA 26.30000
LogP 4.47040

Hexyl octanoate Chemical Properties

IUPAC Name: Hexyl octanoate
Synonyms of Hexyl octanoate (CAS NO.1117-55-1) : Hexyl octanoate ; Octanoic acid, hexyl ester ; Hexyl caprylate ; Hexyl octanoate (natural) ; Hexyl octylate ; n-Hexyl caprylate ; Octanoic acid hexyl ester
Product Categories: Alphabetical Listings;Flavors and Fragrances;G-H
CAS NO:1117-55-1
Molecular Formula:C₁₄H₂₈O₂
Molecular Weight :228.3709
Molecular Structure :
EINECS: 214-247-9
Index of Refraction: 1.435
Surface Tension: 29.6 dyne/cm
Density: 0.867 g/cm³
Flash Point: 120°C
Enthalpy of Vaporization: 51.31 kJ/mol
Boiling Point: 274.7 °C at 760 mmHg
Vapour Pressure: 0.00532 mmHg at 25°C
Melting point: -31°C
Appearance: Hexyl octanoate (CAS NO.1117-55-1) is colorless liquid.
Solubility:Soluble in ethanol, insoluble in water.

Hexyl octanoate Uses

Hexyl octanoate (CAS NO.1117-55-1) is used as food spice.

Hexyl octanoate Production

Raw materials: Octanoic acid-->Hexyl alcohol

Natural product was found in fresh apples, apple juice, apricots, bananas, melon, strawberry juice, beer, malt whiskey, cider, wine, apple brandy .

Hexyl octanoate (CAS NO.1117-55-1) is derived from direct esterification of N-Hexyl alcohol and Caprylic acid .

Hexyl octanoate Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rabbit	LD50	skin	> 5gm/kg (5000mg/kg)		Food and Chemical Toxicology. Vol. 20, Pg. 713, 1982.
rat	LD50	oral	> 5gm/kg (5000mg/kg)		Food and Chemical Toxicology. Vol. 20, Pg. 713, 1982.

Hexyl octanoate Consensus Reports

Reported in EPA TSCA Inventory.

Hexyl octanoate Safety Profile

Mildly toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.

WGK Germany 2
RTECS RH0763500

Product Name

FEMA 2575