Found 1 result

Search term: 3-oxo-D-isoapionate (Found by synonym)
ChemSpider 2D Image | 2,4-Dihydroxy-2-(hydroxymethyl)-3-oxobutanoic acid | C5H8O6

2,4-Dihydroxy-2-(hydroxymethyl)-3-oxobutanoic acid

  • Molecular FormulaC5H8O6
  • Average mass164.113 Da
  • Monoisotopic mass164.032089 Da
  • ChemSpider ID28575995

More details:

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

2,4-Dihydroxy-2-(hydroxymethyl)-3-oxobutanoic acid [ACD/IUPAC Name]
2,4-Dihydroxy-2-(hydroxymethyl)-3-oxobutansäure [German] [ACD/IUPAC Name]
Acide 2,4-dihydroxy-2-(hydroxyméthyl)-3-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2,4-dihydroxy-2-(hydroxymethyl)-3-oxo- [ACD/Index Name]
2,4-Dihydroxy-2-(hydroxymethyl)-3-oxobutanoate
3-Oxo-D-isoapionate
3-Oxoisoapionate
918950-35-3 [RN]
918950-38-6 [RN]
BUTANOIC ACID, 2,4-DIHYDROXY-2-(HYDROXYMETHYL)-3-OXO-, (2R)- [ACD/Index Name]
More...

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

Density: 1.7±0.1 g/cm3
Boiling Point: 493.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.6±6.0 kJ/mol
Flash Point: 266.2±25.2 °C
Index of Refraction: 1.572
Molar Refractivity: 31.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.53
ACD/LogD (pH 5.5): -4.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 102.1±3.0 dyne/cm
Molar Volume: 95.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement