ChemSpider 2D Image | (2S)-2-Amino-1-propanethiol | C3H9NS

(2S)-2-Amino-1-propanethiol

  • Molecular FormulaC3H9NS
  • Average mass91.175 Da
  • Monoisotopic mass91.045570 Da
  • ChemSpider ID23133588

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Amino-1-propanethiol [ACD/IUPAC Name]
(2S)-2-Amino-1-propanethiol [French] [ACD/IUPAC Name]
(2S)-2-Amino-1-propanthiol [German] [ACD/IUPAC Name]
(2S)-2-aminopropane-1-thiol
1-Propanethiol, 2-amino-, (2S)- [ACD/Index Name]
(S)-2-Amino-propane-1-thiol
234452-74-5 [RN]
CHEMBL37279
MFCD19211855

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

Density: 0.9±0.1 g/cm3
Boiling Point: 137.6±23.0 °C at 760 mmHg
Vapour Pressure: 7.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 37.5±3.0 kJ/mol
Flash Point: 37.0±22.6 °C
Index of Refraction: 1.480
Molar Refractivity: 27.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): -2.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability: 10.8±0.5 10-24cm3
Surface Tension: 32.6±3.0 dyne/cm
Molar Volume: 96.2±3.0 cm3

Click to predict properties on the Chemicalize site


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