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Search term: MF = 'C_{21}H_{19}NS'
ChemSpider 2D Image | Benzyl 4-methyl-N-phenylbenzenecarbimidothioate | C21H19NS

Benzyl 4-methyl-N-phenylbenzenecarbimidothioate

  • Molecular FormulaC21H19NS
  • Average mass317.447 Da
  • Monoisotopic mass317.123810 Da
  • ChemSpider ID21421772

  • Double-bond stereo - Double-bond stereo

More details:

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

4-Méthyl-N-phénylbenzènecarbimidothioate de benzyle [French] [ACD/IUPAC Name]
Benzenecarboximidothioic acid, 4-methyl-N-phenyl-, phenylmethyl ester [ACD/Index Name]
Benzyl 4-methyl-N-phenylbenzenecarbimidothioate [ACD/IUPAC Name]
Benzyl-4-methyl-N-phenylbenzolcarbimidothioat [German] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 442.2±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 221.2±26.8 °C
Index of Refraction: 1.590
Molar Refractivity: 102.4±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.81
ACD/LogD (pH 5.5): 5.96
ACD/BCF (pH 5.5): 19817.29
ACD/KOC (pH 5.5): 41436.90
ACD/LogD (pH 7.4): 5.96
ACD/BCF (pH 7.4): 19820.99
ACD/KOC (pH 7.4): 41444.64
Polar Surface Area: 38 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 39.9±7.0 dyne/cm
Molar Volume: 303.4±7.0 cm3

Click to predict properties on the Chemicalize site


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