ChemSpider 2D Image | 2-[2-(Benzylsulfanyl)phenyl]-1,1,3,3-tetramethylguanidine | C18H23N3S

2-[2-(Benzylsulfanyl)phenyl]-1,1,3,3-tetramethylguanidine

  • Molecular FormulaC18H23N3S
  • Average mass313.460 Da
  • Monoisotopic mass313.161255 Da
  • ChemSpider ID30656627

More details:

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

2-[2-(Benzylsulfanyl)phenyl]-1,1,3,3-tetramethylguanidin [German] [ACD/IUPAC Name]
2-[2-(Benzylsulfanyl)phenyl]-1,1,3,3-tetramethylguanidine [ACD/IUPAC Name]
2-[2-(Benzylsulfanyl)phényl]-1,1,3,3-tétraméthylguanidine [French] [ACD/IUPAC Name]
Guanidine, N,N,N',N'-tetramethyl-N''-[2-[(phenylmethyl)thio]phenyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 430.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 214.2±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 98.4±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 2.14
ACD/KOC (pH 5.5): 16.23
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 2.16
ACD/KOC (pH 7.4): 16.32
Polar Surface Area: 44 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 37.1±7.0 dyne/cm
Molar Volume: 302.7±7.0 cm3

Click to predict properties on the Chemicalize site


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