ChemSpider 2D Image | 3-Chloro-3-[hydroxy(methoxy)methyl]dihydro-2(3H)-furanone | C6H9ClO4

3-Chloro-3-[hydroxy(methoxy)methyl]dihydro-2(3H)-furanone

  • Molecular FormulaC6H9ClO4
  • Average mass180.586 Da
  • Monoisotopic mass180.018936 Da
  • ChemSpider ID61037225

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2(3H)-Furanone, 3-chlorodihydro-3-(hydroxymethoxymethyl)- [ACD/Index Name]
3-Chlor-3-[hydroxy(methoxy)methyl]dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
3-Chloro-3-[hydroxy(methoxy)methyl]dihydro-2(3H)-furanone [ACD/IUPAC Name]
3-Chloro-3-[hydroxy(méthoxy)méthyl]dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
167260-78-8 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 268.8±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.9±6.0 kJ/mol
Flash Point: 116.3±24.6 °C
Index of Refraction: 1.495
Molar Refractivity: 37.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.07
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.62
ACD/LogD (pH 7.4): -0.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.62
Polar Surface Area: 56 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 45.9±5.0 dyne/cm
Molar Volume: 129.4±5.0 cm3

Click to predict properties on the Chemicalize site


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