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Search term: YYCCOIONTNLQAS-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-[2-(4,5-Dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1,2-thiazole | C13H13N3OS

5-[2-(4,5-Dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1,2-thiazole

  • Molecular FormulaC13H13N3OS
  • Average mass259.327 Da
  • Monoisotopic mass259.077942 Da
  • ChemSpider ID23218196

More details:

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

5-[2-(4,5-Dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1,2-thiazol [German] [ACD/IUPAC Name]
5-[2-(4,5-Dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1,2-thiazole [ACD/IUPAC Name]
5-[2-(4,5-Dihydro-1H-imidazol-2-ylméthoxy)phényl]-1,2-thiazole [French] [ACD/IUPAC Name]
Isothiazole, 5-[2-[(4,5-dihydro-1H-imidazol-2-yl)methoxy]phenyl]- [ACD/Index Name]
5-[2-(4,5-Dihydro-1H-imidazol-2-ylmethoxy)-phenyl]-isothiazole

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

Density: 1.4±0.1 g/cm3
Boiling Point: 397.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 194.2±27.9 °C
Index of Refraction: 1.690
Molar Refractivity: 73.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.01
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.74
Polar Surface Area: 75 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 54.3±7.0 dyne/cm
Molar Volume: 191.5±7.0 cm3

Click to predict properties on the Chemicalize site


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