ChemSpider 2D Image | (1S)-1-(5-Chloro-2-thienyl)ethanamine | C6H8ClNS

(1S)-1-(5-Chloro-2-thienyl)ethanamine

  • Molecular FormulaC6H8ClNS
  • Average mass161.652 Da
  • Monoisotopic mass161.006592 Da
  • ChemSpider ID25995618

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-(5-Chlor-2-thienyl)ethanamin [German] [ACD/IUPAC Name]
(1S)-1-(5-Chloro-2-thienyl)ethanamine [ACD/IUPAC Name]
(1S)-1-(5-Chloro-2-thiényl)éthanamine [French] [ACD/IUPAC Name]
2-Thiophenemethanamine, 5-chloro-α-methyl-, (αS)- [ACD/Index Name]
(1S)-1-(5-chlorothiophen-2-yl)ethan-1-amine
303070-26-0 [RN]
MFCD09822161 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 218.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.5±3.0 kJ/mol
Flash Point: 85.8±23.2 °C
Index of Refraction: 1.580
Molar Refractivity: 42.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): -1.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.18
Polar Surface Area: 54 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 128.1±3.0 cm3

Click to predict properties on the Chemicalize site


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