Product Name

  • Name

    alpha-n-Butyl-beta-hydroxy-delta(sup alpha,beta)-butenolid [German]

  • EINECS
  • CAS No. 78128-80-0
  • Article Data3
  • CAS DataBase
  • Density 1.173g/cm3
  • Solubility
  • Melting Point
  • Formula C8H12 O3
  • Boiling Point 257.4°C at 760 mmHg
  • Molecular Weight 156.181
  • Flash Point 102.1°C
  • Transport Information
  • Appearance
  • Safety Moderately toxic by subcutaneous and intravenous routes. When heated to decomposition it emits acrid smoke and irritating fumes.
  • Risk Codes
  • Molecular Structure Molecular Structure of 78128-80-0 (alpha-n-Butyl-beta-hydroxy-delta(sup alpha,beta)-butenolid [German])
  • Hazard Symbols
  • Synonyms Hexanoicacid, 2-(1,2-dihydroxyethylidene)-, g-lactone (6CI)
  • PSA 46.53000
  • LogP 1.54550

3-Butyl-4-hydroxy-2(5H)furanone Chemical Properties

IUPAC Name: 4-butyl-5-hydroxyfuran-3-one
Synonyms of 3-Butyl-4-hydroxy-2(5H)furanone (CAS NO.78128-80-0): BRN 5424714 ; alpha-n-Butyl-beta-hydroxy-delta(sup alpha,beta)-butenolid ; alpha-n-Butyl-beta-hydroxy-delta(sup alpha,beta)-butenolid [German] ; 2(5H)Furanone, 3-butyl-4-hydroxy-
CAS NO: 78128-80-0
Molecular Formula of 3-Butyl-4-hydroxy-2(5H)furanone (CAS NO.78128-80-0): C8H12O3
Molecular Weight: 156.1791
Molecular Structure:

H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 4
Polar Surface Area: 35.53 Å2
Index of Refraction: 1.512
Molar Refractivity: 39.96 cm3
Molar Volume: 133.1 cm3
Surface Tension: 44.3 dyne/cm
Density of 3-Butyl-4-hydroxy-2(5H)furanone (CAS NO.78128-80-0): 1.173 g/cm3
Flash Point: 102.1 °C
Enthalpy of Vaporization: 57.5 kJ/mol
Boiling Point: 257.4 °C at 760 mmHg
Vapour Pressure: 0.00216 mmHg at 25°C

3-Butyl-4-hydroxy-2(5H)furanone Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1187mg/kg (1187mg/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 1750mg/kg (1750mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 277, 1961.

3-Butyl-4-hydroxy-2(5H)furanone Safety Profile

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

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