3-Hexenyl isobutyrate supplier

Name
hex-3-enyl isobutyrate
EINECS
CAS No. 57859-47-9
Density 0.891g/cm³
Solubility
Melting Point -89.9°C (estimate)
Formula C10H18 O2
Boiling Point 211.5°C at 760 mmHg
Molecular Weight 170.28
Flash Point 75°C
Transport Information
Appearance
Safety Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Propanoicacid, 2-methyl-, 3-hexenyl ester (9CI); 3-Hexenyl isobutanoate; 3-Hexenylisobutyrate
PSA 26.30000
LogP 2.54190

3-Hexenyl isobutyrate Chemical Properties

Product Name: 3-Hexenyl isobutyrate (CAS NO.57859-47-9)

IUPAC: [(Z)-hex-3-enyl] 2-methylpropanoate
Molecular Formula: C₁₀H₁₈O₂
Molecular Weight: 170.24872g/mol
Mol File: 57859-47-9.mol
EINECS: 260-993-3
Boiling point: 211.5 °C at 760 mmHg
Flash Point: 75 °C
Density: 0.891 g/cm³
Surface Tension: 27.9 dyne/cm
Enthalpy of Vaporization: 44.78 kJ/mol
Vapour Pressure: 0.182 mmHg at 25°C
XLogP3-AA: 2.9
H-Bond Donor: 0
H-Bond Acceptor: 2

3-Hexenyl isobutyrate Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	> 25gm/kg (25000mg/kg)		Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.
rat	LD50	oral	> 25gm/kg (25000mg/kg)		Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.

3-Hexenyl isobutyrate Safety Profile

Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.

3-Hexenyl isobutyrate Specification

3-Hexenyl isobutyrate ,its CAS NO. is 57859-47-9, the synonyms are 3-02-00-00651 (Beilstein Handbook Reference) ; 3-Hexenyl 2-methypropanoate ; 3-Hexenyl isobutanoate ; BRN 1759547 ; Hex-3-enyl isobutyrate ; Propanoic acid, 2-methyl-, 3-hexenyl ester .

Product Name

hex-3-enyl isobutyrate

3-Hexenyl isobutyrate Chemical Properties

3-Hexenyl isobutyrate Toxicity Data With Reference

3-Hexenyl isobutyrate Safety Profile

3-Hexenyl isobutyrate Specification

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