ChemSpider 2D Image | N-(2,2-Diethoxyethyl)-N-hexadecyl-6-nitro-1,3-benzothiazol-2-amine | C29H49N3O4S

N-(2,2-Diethoxyethyl)-N-hexadecyl-6-nitro-1,3-benzothiazol-2-amine

  • Molecular FormulaC29H49N3O4S
  • Average mass535.782 Da
  • Monoisotopic mass535.344360 Da
  • ChemSpider ID102761827

More details:

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

2-Benzothiazolamine, N-(2,2-diethoxyethyl)-N-hexadecyl-6-nitro- [ACD/Index Name]
N-(2,2-Diethoxyethyl)-N-hexadecyl-6-nitro-1,3-benzothiazol-2-amin [German] [ACD/IUPAC Name]
N-(2,2-Diethoxyethyl)-N-hexadecyl-6-nitro-1,3-benzothiazol-2-amine [ACD/IUPAC Name]
N-(2,2-Diéthoxyéthyl)-N-hexadécyl-6-nitro-1,3-benzothiazol-2-amine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 611.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.4±34.3 °C
Index of Refraction: 1.544
Molar Refractivity: 157.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 2
ACD/LogP: 11.44
ACD/LogD (pH 5.5): 10.38
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.38
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 109 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 499.3±3.0 cm3

Click to predict properties on the Chemicalize site


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