ChemSpider 2D Image | (2S)-2-Amino(3,3,3-~2~H_3_)propan-1-ol | C3H6D3NO

(2S)-2-Amino(3,3,3-2H3)propan-1-ol

  • Molecular FormulaC3H6D3NO
  • Average mass78.128 Da
  • Monoisotopic mass78.087242 Da
  • ChemSpider ID24532018

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S)-2-Amino(3,3,3-2H3)propan-1-ol
(2S)-2-Amino-1-(3,3,3-2H3)propanol [ACD/IUPAC Name]
(2S)-2-Amino-1-(3,3,3-2H3)propanol [German] [ACD/IUPAC Name]
(2S)-2-Amino-1-(3,3,3-2H3)propanol [French] [ACD/IUPAC Name]
1-Propan-3,3,3-d3-ol, 2-amino-, (2S)- [ACD/Index Name]
(S)-(+)-2-Amino-1-propanol-3,3,3-d3
352438-84-7 [RN]
L-Alaninol
S(+)-2-Amino-1-propanol-3,3,3-d3
β-Propanolamine

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

Density: 0.9±0.1 g/cm3
Boiling Point: 174.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.7 mmHg at 25°C
Enthalpy of Vaporization: 47.8±6.0 kJ/mol
Flash Point: 83.9±0.0 °C
Index of Refraction: 1.440
Molar Refractivity: 21.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.96
ACD/LogD (pH 5.5): -3.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 46 Å2
Polarizability: 8.3±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 79.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement