Found 243 results

Search term: MF = 'C_{11}H_{8}BrN_{3}O_{4}'
ChemSpider 2D Image | 1-(3-Bromobenzyl)-3-nitro-1H-pyrazole-4-carboxylic acid | C11H8BrN3O4

1-(3-Bromobenzyl)-3-nitro-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC11H8BrN3O4
  • Average mass326.103 Da
  • Monoisotopic mass324.969818 Da
  • ChemSpider ID53608048

More details:

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

1-(3-Brombenzyl)-3-nitro-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(3-Bromobenzyl)-3-nitro-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1H-Pyrazole-4-carboxylic acid, 1-[(3-bromophenyl)methyl]-3-nitro- [ACD/Index Name]
Acide 1-(3-bromobenzyl)-3-nitro-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
1-[(3-BROMOPHENYL)METHYL]-3-NITRO-1H-PYRAZOLE-4-CARBOXYLIC ACID
1-[(3-BROMOPHENYL)METHYL]-3-NITROPYRAZOLE-4-CARBOXYLIC ACID
1856043-36-1 [RN]
MFCD29911889

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

Density: 1.8±0.1 g/cm3
Boiling Point: 548.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 285.5±30.1 °C
Index of Refraction: 1.703
Molar Refractivity: 70.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): -0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 70.5±7.0 dyne/cm
Molar Volume: 180.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement