ChemSpider 2D Image | (3S)-3-Hydroxybutanal | C4H8O2

(3S)-3-Hydroxybutanal

  • Molecular FormulaC4H8O2
  • Average mass88.105 Da
  • Monoisotopic mass88.052429 Da
  • ChemSpider ID32971643

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Hydroxybutanal [German] [ACD/IUPAC Name]
(3S)-3-Hydroxybutanal [ACD/IUPAC Name]
(3S)-3-Hydroxybutanal [French] [ACD/IUPAC Name]
Butanal, 3-hydroxy-, (3S)- [ACD/Index Name]
(3R)-3-hydroxybutanal [ACD/IUPAC Name]
(3R)-3-hydroxybutyraldehyde
107-89-1 [RN]
117706-98-6 [RN]
203-530-2 [EINECS]
Acetaldol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 162.2±23.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.7 mmHg at 25°C
Enthalpy of Vaporization: 46.4±6.0 kJ/mol
Flash Point: 58.7±15.2 °C
Index of Refraction: 1.410
Molar Refractivity: 22.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.02
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.02
Polar Surface Area: 37 Å2
Polarizability: 8.8±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 89.8±3.0 cm3

Click to predict properties on the Chemicalize site


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