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Search term: MF = 'C_{18}H_{24}O_{4}S'

ChemSpider 2D Image | 2-Benzylcyclopentyl (1,1-dioxidotetrahydro-3-thiophenyl)acetate | C18H24O4S

2-Benzylcyclopentyl (1,1-dioxidotetrahydro-3-thiophenyl)acetate

  • Molecular FormulaC18H24O4S
  • Average mass336.446 Da
  • Monoisotopic mass336.139526 Da
  • ChemSpider ID30262657

More details:






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

(1,1-Dioxydotétrahydro-3-thiophényl)acétate de 2-benzylcyclopentyle [French] [ACD/IUPAC Name]
2-Benzylcyclopentyl (1,1-dioxidotetrahydro-3-thiophenyl)acetate [ACD/IUPAC Name]
2-Benzylcyclopentyl-(1,1-dioxidotetrahydro-3-thiophenyl)acetat [German] [ACD/IUPAC Name]
3-Thiopheneacetic acid, tetrahydro-, 2-(phenylmethyl)cyclopentyl ester, 1,1-dioxide [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: 510.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 262.8±22.6 °C
Index of Refraction: 1.563
Molar Refractivity: 88.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 87.68
ACD/KOC (pH 5.5): 855.76
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 87.68
ACD/KOC (pH 7.4): 855.76
Polar Surface Area: 69 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 49.2±5.0 dyne/cm
Molar Volume: 273.5±5.0 cm3

Click to predict properties on the Chemicalize site






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