ChemSpider 2D Image | 4-[(4-Isothiocyanatophenyl)azo]-N,N-dimethylaniline | C15H14N4S

4-[(4-Isothiocyanatophenyl)azo]-N,N-dimethylaniline

  • Molecular FormulaC15H14N4S
  • Average mass282.363 Da
  • Monoisotopic mass282.093903 Da
  • ChemSpider ID21172708

More details:

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

231-521-3 [EINECS]
4-[(4-Isothiocyanatophenyl)azo]-N,N-dimethylaniline [ACD/IUPAC Name]
4-[(4-Isothiocyanatophenyl)diazenyl]-N,N-dimethylanilin [German] [ACD/IUPAC Name]
4-[(4-Isothiocyanatophényl)diazényl]-N,N-diméthylaniline [French] [ACD/IUPAC Name]
4-[2-(4-Isothiocyanatophenyl)diazenyl]-N,N-dimethyl[benzenamine]
7612-98-8 [RN]
Benzenamine, 4-[2-(4-isothiocyanatophenyl)diazenyl]-N,N-dimethyl- [ACD/Index Name]
SCNR DNUNR DN1&1 [WLN]
4-[(4-Isothiocyanatophenyl)diazenyl]-N,N-dimethylaniline
4-{[4-(Dimethylamino)phenyl]diazenyl}benzenisothiocyanate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.1±0.1 g/cm3
Boiling Point: 466.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 235.7±24.6 °C
Index of Refraction: 1.613
Molar Refractivity: 86.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 5.52
ACD/BCF (pH 5.5): 9178.58
ACD/KOC (pH 5.5): 23845.17
ACD/LogD (pH 7.4): 5.52
ACD/BCF (pH 7.4): 9233.39
ACD/KOC (pH 7.4): 23987.57
Polar Surface Area: 72 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 41.3±7.0 dyne/cm
Molar Volume: 249.0±7.0 cm3

Click to predict properties on the Chemicalize site


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