Found 86 results

Search term: MF = 'C_{16}H_{14}N_{2}O_{8}'
ChemSpider 2D Image | Trimethyl 5-(4-nitrophenyl)-1H-pyrrole-2,3,4-tricarboxylate | C16H14N2O8

Trimethyl 5-(4-nitrophenyl)-1H-pyrrole-2,3,4-tricarboxylate

  • Molecular FormulaC16H14N2O8
  • Average mass362.291 Da
  • Monoisotopic mass362.075012 Da
  • ChemSpider ID28699990

More details:

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

1H-Pyrrole-2,3,4-tricarboxylic acid, 5-(4-nitrophenyl)-, trimethyl ester [ACD/Index Name]
5-(4-Nitrophényl)-1H-pyrrole-2,3,4-tricarboxylate de triméthyle [French] [ACD/IUPAC Name]
Trimethyl 5-(4-nitrophenyl)-1H-pyrrole-2,3,4-tricarboxylate [ACD/IUPAC Name]
Trimethyl-5-(4-nitrophenyl)-1H-pyrrol-2,3,4-tricarboxylat [German] [ACD/IUPAC Name]
89330-92-7 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 599.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 316.4±30.1 °C
Index of Refraction: 1.589
Molar Refractivity: 87.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 39.01
ACD/KOC (pH 5.5): 479.22
ACD/LogD (pH 7.4): 2.40
ACD/BCF (pH 7.4): 38.99
ACD/KOC (pH 7.4): 479.07
Polar Surface Area: 141 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 258.6±3.0 cm3

Click to predict properties on the Chemicalize site


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