Found 164 results

Search term: MF = 'C_{17}H_{18}FN_{3}S'
ChemSpider 2D Image | 1-[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]-N-methyl-N-[(3-methyl-2-thienyl)methyl]methanamine | C17H18FN3S

1-[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]-N-methyl-N-[(3-methyl-2-thienyl)methyl]methanamine

  • Molecular FormulaC17H18FN3S
  • Average mass315.408 Da
  • Monoisotopic mass315.120544 Da
  • ChemSpider ID29611476

More details:

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

1-[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]-N-methyl-N-[(3-methyl-2-thienyl)methyl]methanamine [ACD/IUPAC Name]
1-[3-(4-Fluorophényl)-1H-pyrazol-4-yl]-N-méthyl-N-[(3-méthyl-2-thiényl)méthyl]méthanamine [French] [ACD/IUPAC Name]
1-[3-(4-Fluorphenyl)-1H-pyrazol-4-yl]-N-methyl-N-[(3-methyl-2-thienyl)methyl]methanamin [German] [ACD/IUPAC Name]
1H-Pyrazole-4-methanamine, 3-(4-fluorophenyl)-N-methyl-N-[(3-methyl-2-thienyl)methyl]- [ACD/Index Name]
{[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]METHYL}(METHYL)[(3-METHYLTHIOPHEN-2-YL)METHYL]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: 474.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 240.8±28.7 °C
Index of Refraction: 1.619
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 21.46
ACD/KOC (pH 5.5): 126.95
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 395.15
ACD/KOC (pH 7.4): 2337.39
Polar Surface Area: 60 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 253.5±3.0 cm3

Click to predict properties on the Chemicalize site


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