ChemSpider 2D Image | (1R)-2-Amino-1-phenylethanethiol | C8H11NS

(1R)-2-Amino-1-phenylethanethiol

  • Molecular FormulaC8H11NS
  • Average mass153.245 Da
  • Monoisotopic mass153.061218 Da
  • ChemSpider ID97926535

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-2-Amino-1-phenylethanethiol [ACD/IUPAC Name]
(1R)-2-Amino-1-phényléthanethiol [French] [ACD/IUPAC Name]
(1R)-2-Amino-1-phenylethanthiol [German] [ACD/IUPAC Name]
Benzenemethanethiol, α-(aminomethyl)-, (αR)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 245.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.3±3.0 kJ/mol
Flash Point: 102.5±24.0 °C
Index of Refraction: 1.586
Molar Refractivity: 47.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 1.93
ACD/KOC (pH 7.4): 31.02
Polar Surface Area: 65 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 140.7±3.0 cm3

Click to predict properties on the Chemicalize site


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