ChemSpider 2D Image | (2S,3R)-3-Chloro-2-hydroxybutanoic acid | C4H7ClO3

(2S,3R)-3-Chloro-2-hydroxybutanoic acid

  • Molecular FormulaC4H7ClO3
  • Average mass138.550 Da
  • Monoisotopic mass138.008377 Da
  • ChemSpider ID32991014
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2S,3R)-3-Chlor-2-hydroxybutansäure [German] [ACD/IUPAC Name]
(2S,3R)-3-Chloro-2-hydroxybutanoic acid [ACD/IUPAC Name]
Acide (2S,3R)-3-chloro-2-hydroxybutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-chloro-2-hydroxy-, (2S,3R)- [ACD/Index Name]
82614-89-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 254.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 57.1±6.0 kJ/mol
Flash Point: 107.5±21.8 °C
Index of Refraction: 1.487
Molar Refractivity: 28.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.24
ACD/LogD (pH 5.5): -2.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 11.3±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 98.8±3.0 cm3

Click to predict properties on the Chemicalize site






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