ChemSpider 2D Image | 3-(3-Methylphenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione | C16H20N2S

3-(3-Methylphenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione

  • Molecular FormulaC16H20N2S
  • Average mass272.408 Da
  • Monoisotopic mass272.134705 Da
  • ChemSpider ID26456668

More details:

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

1,4-Diazaspiro[4.6]undec-3-ene-2-thione, 3-(3-methylphenyl)- [ACD/Index Name]
3-(3-Methylphenyl)-1,4-diazaspiro[4.6]undec-3-en-2-thion [German] [ACD/IUPAC Name]
3-(3-Methylphenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione [ACD/IUPAC Name]
3-(3-Méthylphényl)-1,4-diazaspiro[4.6]undéc-3-ène-2-thione [French] [ACD/IUPAC Name]
[1325305-60-9] [RN]
1325305-60-9 [RN]
3-m-Tolyl-1,4-diaza-spiro[4.6]undec-3-ene-2-thione
BS-4949
MFCD19705649

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

Density: 1.2±0.1 g/cm3
Boiling Point: 406.9±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 199.9±26.8 °C
Index of Refraction: 1.645
Molar Refractivity: 82.4±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1538.30
ACD/KOC (pH 5.5): 6567.89
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1606.68
ACD/KOC (pH 7.4): 6859.83
Polar Surface Area: 56 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 43.4±7.0 dyne/cm
Molar Volume: 227.3±7.0 cm3

Click to predict properties on the Chemicalize site


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