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Search term: CC(C)=CCn1nc(-c2ccc(O)cc2O)c2cccc(c12)C(F)(F)F (Found by conversion of search term to chemical structure (full match))

ChemSpider 2D Image | 4-[1-(3-Methyl-2-buten-1-yl)-7-(trifluoromethyl)-1H-indazol-3-yl]-1,3-benzenediol | C19H17F3N2O2

4-[1-(3-Methyl-2-buten-1-yl)-7-(trifluoromethyl)-1H-indazol-3-yl]-1,3-benzenediol

  • Molecular FormulaC19H17F3N2O2
  • Average mass362.346 Da
  • Monoisotopic mass362.124207 Da
  • ChemSpider ID24747119

More details:






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

1,3-Benzenediol, 4-[1-(3-methyl-2-buten-1-yl)-7-(trifluoromethyl)-1H-indazol-3-yl]- [ACD/Index Name]
4-[1-(3-Methyl-2-buten-1-yl)-7-(trifluormethyl)-1H-indazol-3-yl]-1,3-benzoldiol [German] [ACD/IUPAC Name]
4-[1-(3-Methyl-2-buten-1-yl)-7-(trifluoromethyl)-1H-indazol-3-yl]-1,3-benzenediol [ACD/IUPAC Name]
4-[1-(3-Méthyl-2-butén-1-yl)-7-(trifluorométhyl)-1H-indazol-3-yl]-1,3-benzènediol [French] [ACD/IUPAC Name]
4-[1-(3-methylbut-2-en-1-yl)-7-(trifluoromethyl)-1H-indazol-3-yl]benzene-1,3-diol
1255706-39-8 [RN]
4-(1-(3-Methylbut-2-enyl)-7-(trifluoromethyl)-1H-indazol-3-yl)benzene-1,3-diol
KN3

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

Density: 1.3±0.1 g/cm3
Boiling Point: 516.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 266.0±30.1 °C
Index of Refraction: 1.575
Molar Refractivity: 91.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 908.68
ACD/KOC (pH 5.5): 4558.63
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 724.98
ACD/KOC (pH 7.4): 3637.07
Polar Surface Area: 58 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 39.3±7.0 dyne/cm
Molar Volume: 275.2±7.0 cm3

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