ChemSpider 2D Image | (5S)-5-[(3S)-3-Heptanyl]-3-[(trichloromethyl)sulfanyl]-2,4-imidazolidinedione | C11H17Cl3N2O2S

(5S)-5-[(3S)-3-Heptanyl]-3-[(trichloromethyl)sulfanyl]-2,4-imidazolidinedione

  • Molecular FormulaC11H17Cl3N2O2S
  • Average mass347.689 Da
  • Monoisotopic mass346.007629 Da
  • ChemSpider ID34994903

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5S)-5-[(3S)-3-Heptanyl]-3-[(trichlormethyl)sulfanyl]-2,4-imidazolidindion [German] [ACD/IUPAC Name]
(5S)-5-[(3S)-3-Heptanyl]-3-[(trichloromethyl)sulfanyl]-2,4-imidazolidinedione [ACD/IUPAC Name]
(5S)-5-[(3S)-3-Heptanyl]-3-[(trichlorométhyl)sulfanyl]-2,4-imidazolidinedione [French] [ACD/IUPAC Name]
2,4-Imidazolidinedione, 5-[(1S)-1-ethylpentyl]-3-[(trichloromethyl)thio]-, (5S)- [ACD/Index Name]
226-995-3 [EINECS]
5588-20-5 [RN]
chlordantoin [USAN]
UNII-W14Z7581PA

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.563
Molar Refractivity: 81.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1211.28
ACD/KOC (pH 5.5): 5443.33
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 150.20
ACD/KOC (pH 7.4): 674.97
Polar Surface Area: 75 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 250.1±5.0 cm3

Click to predict properties on the Chemicalize site


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