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Name	4-Hydroxy-5-octyl-2(5H)furanone	EINECS	N/A
CAS No.	78128-84-4	Density	1.055g/cm³
PSA	46.53000	LogP	3.10430
Solubility	N/A	Melting Point	N/A
Formula	C₁₂H₂₀O₃	Boiling Point	317.3°C at 760 mmHg
Molecular Weight	212.32	Flash Point	114.6°C
Transport Information	N/A	Appearance	N/A
Safety	Poison by intravenous route. Moderately toxic by subcutaneous route. When heated to decomposition it emits acrid smoke and fumes.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	5-hydroxy-2-octylfuran-3-one;

4-Hydroxy-5-octyl-2(5H)furanone Chemical Properties

Product Name: 4-Hydroxy-5-octyl-2(5H)furanone (CAS NO.78128-84-4)

Molecular Formula: C₁₂H₂₀O₃
Molecular Weight: 212.32g/mol
Mol File: 78128-84-4.mol
Boiling point: 317.3 °C at 760 mmHg
Flash Point: 114.6 °C
Density: 1.055 g/cm³
Surface Tension: 39.8 dyne/cm
Enthalpy of Vaporization: 64.76 kJ/mol
Vapour Pressure: 3.26E-05 mmHg at 25°C
XLogP3-AA: 3.9
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 4-Hydroxy-5-octyl-2(5H)furanone (CAS NO.78128-84-4):
IUPAC Name: 5-Hydroxy-2-octylfuran-3-one
Canonical SMILES: CCCCCCCCC1C(=O)C=C(O1)O
InChI: InChI=1S/C12H20O3/c1-2-3-4-5-6-7-8-11-10(13)9-12(14)15-11/h9,11,14H,2-8H2,1H3
InChIKey: YKDQGFFCCVUDIR-UHFFFAOYSA-N

4-Hydroxy-5-octyl-2(5H)furanone Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intravenous	160mg/kg (160mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 277, 1961.
mouse	LD50	subcutaneous	550mg/kg (550mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 277, 1961.

4-Hydroxy-5-octyl-2(5H)furanone Safety Profile

Poison by intravenous route. Moderately toxic by subcutaneous route. When heated to decomposition it emits acrid smoke and fumes.

4-Hydroxy-5-octyl-2(5H)furanone Specification

4-Hydroxy-5-octyl-2(5H)furanone , its CAS NO. is 78128-84-4, the synonyms are gamma-Octyl-beta-hydroxy-delta(sup alpha,beta)-butenolid ; 2(5H)Furanone, 4-hydroxy-5-octyl- .

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