ChemSpider 2D Image | 4-(Hydroxymethyl)-2-isobutyl-3-furoic acid | C10H14O4

4-(Hydroxymethyl)-2-isobutyl-3-furoic acid

  • Molecular FormulaC10H14O4
  • Average mass198.216 Da
  • Monoisotopic mass198.089203 Da
  • ChemSpider ID59702850

More details:

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

3-Furancarboxylic acid, 4-(hydroxymethyl)-2-(2-methylpropyl)- [ACD/Index Name]
4-(Hydroxymethyl)-2-isobutyl-3-furoesäure [German] [ACD/IUPAC Name]
4-(Hydroxymethyl)-2-isobutyl-3-furoic acid [ACD/IUPAC Name]
Acide 4-(hydroxyméthyl)-2-isobutyl-3-furoïque [French] [ACD/IUPAC Name]
1173281-61-2 [RN]
E'AGN-PC-072LSN'
MFCD20660408

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

Density: 1.2±0.1 g/cm3
Boiling Point: 228.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 92.2±21.8 °C
Index of Refraction: 1.528
Molar Refractivity: 50.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.95
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 71 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 164.8±3.0 cm3

Click to predict properties on the Chemicalize site


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