ChemSpider 2D Image | 8-[(3,4-Dichlorophenyl)sulfonyl]-3-isopropyl-1-(tetrahydro-2-furanylmethyl)-1,4,8-triazaspiro[4.5]decan-2-one | C21H29Cl2N3O4S

8-[(3,4-Dichlorophenyl)sulfonyl]-3-isopropyl-1-(tetrahydro-2-furanylmethyl)-1,4,8-triazaspiro[4.5]decan-2-one

  • Molecular FormulaC21H29Cl2N3O4S
  • Average mass490.444 Da
  • Monoisotopic mass489.125580 Da
  • ChemSpider ID22688626

More details:

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

1,4,8-Triazaspiro[4.5]decan-2-one, 8-[(3,4-dichlorophenyl)sulfonyl]-3-(1-methylethyl)-1-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
8-[(3,4-Dichlorophenyl)sulfonyl]-3-isopropyl-1-(tetrahydro-2-furanylmethyl)-1,4,8-triazaspiro[4.5]decan-2-one [ACD/IUPAC Name]
8-[(3,4-Dichlorophényl)sulfonyl]-3-isopropyl-1-(tétrahydro-2-furanylméthyl)-1,4,8-triazaspiro[4.5]décan-2-one [French] [ACD/IUPAC Name]
8-[(3,4-Dichlorphenyl)sulfonyl]-3-isopropyl-1-(tetrahydro-2-furanylmethyl)-1,4,8-triazaspiro[4.5]decan-2-on [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 656.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 350.7±34.3 °C
Index of Refraction: 1.623
Molar Refractivity: 121.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 653.73
ACD/KOC (pH 5.5): 3591.16
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 662.30
ACD/KOC (pH 7.4): 3638.24
Polar Surface Area: 87 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 345.5±5.0 cm3

Click to predict properties on the Chemicalize site


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