ChemSpider 2D Image | (2E)-3-Chloro-N-(1,4-dithian-2-ylmethyl)-2-propen-1-amine | C8H14ClNS2

(2E)-3-Chloro-N-(1,4-dithian-2-ylmethyl)-2-propen-1-amine

  • Molecular FormulaC8H14ClNS2
  • Average mass223.786 Da
  • Monoisotopic mass223.025620 Da
  • ChemSpider ID55959217

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-Chlor-N-(1,4-dithian-2-ylmethyl)-2-propen-1-amin [German] [ACD/IUPAC Name]
(2E)-3-Chloro-N-(1,4-dithian-2-ylmethyl)-2-propen-1-amine [ACD/IUPAC Name]
(2E)-3-Chloro-N-(1,4-dithian-2-ylméthyl)-2-propén-1-amine [French] [ACD/IUPAC Name]
1,4-Dithiane-2-methanamine, N-[(2E)-3-chloro-2-propen-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 349.5±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 165.2±25.1 °C
Index of Refraction: 1.565
Molar Refractivity: 61.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.19
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 9.30
ACD/KOC (pH 7.4): 111.73
Polar Surface Area: 63 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 189.8±3.0 cm3

Click to predict properties on the Chemicalize site


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