Found 225 results

Search term: MF = 'C_{18}H_{15}BrFN'
ChemSpider 2D Image | 1-(3-Bromo-5-fluorobenzyl)-1,2,3,4-tetrahydro-1-naphthalenecarbonitrile | C18H15BrFN

1-(3-Bromo-5-fluorobenzyl)-1,2,3,4-tetrahydro-1-naphthalenecarbonitrile

  • Molecular FormulaC18H15BrFN
  • Average mass344.221 Da
  • Monoisotopic mass343.037170 Da
  • ChemSpider ID36063526

More details:

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

1-(3-Brom-5-fluorbenzyl)-1,2,3,4-tetrahydro-1-naphthalincarbonitril [German] [ACD/IUPAC Name]
1-(3-Bromo-5-fluorobenzyl)-1,2,3,4-tétrahydro-1-naphtalènecarbonitrile [French] [ACD/IUPAC Name]
1-(3-Bromo-5-fluorobenzyl)-1,2,3,4-tetrahydro-1-naphthalenecarbonitrile [ACD/IUPAC Name]
1-Naphthalenecarbonitrile, 1-[(3-bromo-5-fluorophenyl)methyl]-1,2,3,4-tetrahydro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 456.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 229.6±27.3 °C
Index of Refraction: 1.623
Molar Refractivity: 85.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 5.72
ACD/BCF (pH 5.5): 13013.75
ACD/KOC (pH 5.5): 30667.41
ACD/LogD (pH 7.4): 5.72
ACD/BCF (pH 7.4): 13013.75
ACD/KOC (pH 7.4): 30667.41
Polar Surface Area: 24 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 53.1±5.0 dyne/cm
Molar Volume: 241.0±5.0 cm3

Click to predict properties on the Chemicalize site


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