ChemSpider 2D Image | (1S,2S)-1-Phenyl-2-(1-pyrrolidinyl)-1-propanol | C13H19NO

(1S,2S)-1-Phenyl-2-(1-pyrrolidinyl)-1-propanol

  • Molecular FormulaC13H19NO
  • Average mass205.296 Da
  • Monoisotopic mass205.146667 Da
  • ChemSpider ID52085247

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2S)-1-Phenyl-2-(1-pyrrolidinyl)-1-propanol [German] [ACD/IUPAC Name]
(1S,2S)-1-Phenyl-2-(1-pyrrolidinyl)-1-propanol [ACD/IUPAC Name]
(1S,2S)-1-Phényl-2-(1-pyrrolidinyl)-1-propanol [French] [ACD/IUPAC Name]
(1S,2S)-1-phenyl-2-(pyrrolidin-1-yl)propan-1-ol
1771698-89-5 [RN]
1-Pyrrolidineethanol, β-methyl-α-phenyl-, (αS,βS)- [ACD/Index Name]
1-PHENYL-2-(PYRROLIDIN-1-YL)PROPAN-1-OL, (1S,2S)-

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

3N5140V4IH [DBID]
UNII:3N5140V4IH [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 321.3±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 148.1±21.0 °C
Index of Refraction: 1.562
Molar Refractivity: 61.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 23 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 190.8±3.0 cm3

Click to predict properties on the Chemicalize site


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