ChemSpider 2D Image | 1-[2-(Ethylsulfanyl)ethyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidine | C11H21N5S

1-[2-(Ethylsulfanyl)ethyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidine

  • Molecular FormulaC11H21N5S
  • Average mass255.383 Da
  • Monoisotopic mass255.151764 Da
  • ChemSpider ID28687813

More details:

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

1-[2-(Ethylsulfanyl)ethyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidin [German] [ACD/IUPAC Name]
1-[2-(Ethylsulfanyl)ethyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidine [ACD/IUPAC Name]
1-[2-(Éthylsulfanyl)éthyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidine [French] [ACD/IUPAC Name]
Guanidine, N-[2-(ethylthio)ethyl]-N'-[3-(1H-imidazol-4-yl)propyl]- [ACD/Index Name]
1-(3-(1H-Imidazol-5-yl)propyl)-3-(2-(ethylthio)ethyl)guanidine
144036-38-4 [RN]
N-[2-(Ethylsulfanyl)ethyl]-N''-[3-(1H-imidazol-5-yl)propyl]guanidine
N-[2-(ETHYLSULFANYL)ETHYL]-N''-[3-(3H-IMIDAZOL-4-YL)PROPYL]GUANIDINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 462.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 233.7±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 72.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 210.5±7.0 cm3

Click to predict properties on the Chemicalize site


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