ChemSpider 2D Image | 1-Amino-1,1,2-butanetriol | C4H11NO3

1-Amino-1,1,2-butanetriol

  • Molecular FormulaC4H11NO3
  • Average mass121.135 Da
  • Monoisotopic mass121.073891 Da
  • ChemSpider ID32974683

More details:

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

1,1,2-Butanetriol, 1-amino- [ACD/Index Name]
1-Amino-1,1,2-butanetriol [ACD/IUPAC Name]
1-Amino-1,1,2-butanetriol [French] [ACD/IUPAC Name]
1-Amino-1,1,2-butantriol [German] [ACD/IUPAC Name]
1314926-74-3 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 334.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 156.3±27.9 °C
Index of Refraction: 1.541
Molar Refractivity: 28.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.68
ACD/LogD (pH 5.5): -4.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 11.4±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 91.2±3.0 cm3

Click to predict properties on the Chemicalize site


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