ChemSpider 2D Image | N-(1,3-Thiazol-4-ylmethyl)-N-(3-thienylmethyl)-2-butanamine | C13H18N2S2

N-(1,3-Thiazol-4-ylmethyl)-N-(3-thienylmethyl)-2-butanamine

  • Molecular FormulaC13H18N2S2
  • Average mass266.425 Da
  • Monoisotopic mass266.091125 Da
  • ChemSpider ID35092359

More details:

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

4-Thiazolemethanamine, N-(1-methylpropyl)-N-(3-thienylmethyl)- [ACD/Index Name]
N-(1,3-Thiazol-4-ylmethyl)-N-(3-thienylmethyl)-2-butanamin [German] [ACD/IUPAC Name]
N-(1,3-Thiazol-4-ylmethyl)-N-(3-thienylmethyl)-2-butanamine [ACD/IUPAC Name]
N-(1,3-Thiazol-4-ylméthyl)-N-(3-thiénylméthyl)-2-butanamine [French] [ACD/IUPAC Name]
N-(1,3-thiazol-4-ylmethyl)-N-(3-thienylmethyl)butan-2-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 352.8±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.8±3.0 kJ/mol
Flash Point: 167.1±23.7 °C
Index of Refraction: 1.591
Molar Refractivity: 77.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 7.59
ACD/KOC (pH 5.5): 59.40
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 145.77
ACD/KOC (pH 7.4): 1140.38
Polar Surface Area: 73 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 228.8±3.0 cm3

Click to predict properties on the Chemicalize site


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