ChemSpider 2D Image | 1,1-Dimethyl-3-(3-sulfanylpropyl)guanidine | C6H15N3S

1,1-Dimethyl-3-(3-sulfanylpropyl)guanidine

  • Molecular FormulaC6H15N3S
  • Average mass161.268 Da
  • Monoisotopic mass161.098663 Da
  • ChemSpider ID24196681

More details:

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

1,1-Dimethyl-3-(3-sulfanylpropyl)guanidin [German] [ACD/IUPAC Name]
1,1-Dimethyl-3-(3-sulfanylpropyl)guanidine [ACD/IUPAC Name]
1,1-Diméthyl-3-(3-sulfanylpropyl)guanidine [French] [ACD/IUPAC Name]
Guanidine, N'-(3-mercaptopropyl)-N,N-dimethyl- [ACD/Index Name]
3-(3-mercaptopropyl)-1,1-dimethylguanidine
735253-59-5 [RN]
Guanidine, N-(3-mercaptopropyl)-N,N-dimethyl- (9CI)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 218.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.5±3.0 kJ/mol
Flash Point: 86.1±27.9 °C
Index of Refraction: 1.534
Molar Refractivity: 46.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.23
ACD/LogD (pH 5.5): -1.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 18.3±0.5 10-24cm3
Surface Tension: 35.1±7.0 dyne/cm
Molar Volume: 148.2±7.0 cm3

Click to predict properties on the Chemicalize site


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