ChemSpider 2D Image | (1R,2S)-2-(3-Thienyl)cyclopropanamine | C7H9NS

(1R,2S)-2-(3-Thienyl)cyclopropanamine

  • Molecular FormulaC7H9NS
  • Average mass139.218 Da
  • Monoisotopic mass139.045563 Da
  • ChemSpider ID23315879

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S)-2-(3-Thienyl)cyclopropanamin [German] [ACD/IUPAC Name]
(1R,2S)-2-(3-Thienyl)cyclopropanamine [ACD/IUPAC Name]
(1R,2S)-2-(3-Thiényl)cyclopropanamine [French] [ACD/IUPAC Name]
(1R,2S)-2-(thiophen-3-yl)cyclopropanamine
Cyclopropanamine, 2-(3-thienyl)-, (1R,2S)- [ACD/Index Name]
1821743-32-1 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL402865/
MFCD30487494
rac-(1R,2S)-2-(thiophen-3-yl)cyclopropan-1-amine
trans-2-(thiophen-3-yl)cyclopropanamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 227.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.5±3.0 kJ/mol
Flash Point: 91.6±25.4 °C
Index of Refraction: 1.620
Molar Refractivity: 40.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): -1.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.41
Polar Surface Area: 54 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 114.5±3.0 cm3

Click to predict properties on the Chemicalize site


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