ChemSpider 2D Image | (S)-3-bromolactic acid | C3H5BrO3

(S)-3-bromolactic acid

  • Molecular FormulaC3H5BrO3
  • Average mass168.974 Da
  • Monoisotopic mass167.942200 Da
  • ChemSpider ID52085336

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-Brom-2-hydroxypropansäure [German] [ACD/IUPAC Name]
(2S)-3-Bromo-2-hydroxypropanoic acid [ACD/IUPAC Name]
(S)-3-bromolactic acid
29576-80-5 [RN]
Acide (2S)-3-bromo-2-hydroxypropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-bromo-2-hydroxy-, (2S)- [ACD/Index Name]
3-BROMOLACTIC ACID, (S)-

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

7412507DY1 [DBID]
UNII:7412507DY1 [DBID]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 314.0±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.4±6.0 kJ/mol
Flash Point: 143.7±23.7 °C
Index of Refraction: 1.551
Molar Refractivity: 26.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): -2.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 10.6±0.5 10-24cm3
Surface Tension: 67.0±3.0 dyne/cm
Molar Volume: 83.7±3.0 cm3

Click to predict properties on the Chemicalize site


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