ChemSpider 2D Image | 1-(3-Chloro-2-pyridinyl)-3-{[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl}-1H-pyrazole-5-carboxylic acid | C12H7ClF3N7O2

1-(3-Chloro-2-pyridinyl)-3-{[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl}-1H-pyrazole-5-carboxylic acid

  • Molecular FormulaC12H7ClF3N7O2
  • Average mass373.678 Da
  • Monoisotopic mass373.030182 Da
  • ChemSpider ID59650541

More details:

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

1-(3-Chlor-2-pyridinyl)-3-{[5-(trifluormethyl)-2H-tetrazol-2-yl]methyl}-1H-pyrazol-5-carbonsäure [German] [ACD/IUPAC Name]
1-(3-Chloro-2-pyridinyl)-3-[[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl]-1H-pyrazole-5-carboxylic acid
1-(3-Chloro-2-pyridinyl)-3-{[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl}-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
1-(3-Chloropyridin-2-yl)-3-{[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl}-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
1352319-02-8 [RN]
1H-Pyrazole-5-carboxylic acid, 1-(3-chloro-2-pyridinyl)-3-[[5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl]- [ACD/Index Name]
Acide 1-(3-chloro-2-pyridinyl)-3-{[5-(trifluorométhyl)-2H-tétrazol-2-yl]méthyl}-1H-pyrazole-5-carboxylique [French] [ACD/IUPAC Name]
T6NJ CG B- AT5NNJ EVQ C1- BT5NNNNJ EXFFF [WLN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 561.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 293.6±32.9 °C
Index of Refraction: 1.714
Molar Refractivity: 79.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 64.4±7.0 dyne/cm
Molar Volume: 203.3±7.0 cm3

Click to predict properties on the Chemicalize site


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