ChemSpider 2D Image | [3-(1-Azetidinylmethyl)phenyl](4-bromophenyl)methanone | C17H16BrNO

[3-(1-Azetidinylmethyl)phenyl](4-bromophenyl)methanone

  • Molecular FormulaC17H16BrNO
  • Average mass330.219 Da
  • Monoisotopic mass329.041504 Da
  • ChemSpider ID21399571

More details:

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

(3-(Azetidin-1-ylmethyl)phenyl)(4-bromophenyl)methanone
[3-(1-Azetidinylmethyl)phenyl](4-bromophenyl)methanone [ACD/IUPAC Name]
[3-(1-Azétidinylméthyl)phényl](4-bromophényl)méthanone [French] [ACD/IUPAC Name]
[3-(1-Azetidinylmethyl)phenyl](4-bromphenyl)methanon [German] [ACD/IUPAC Name]
898771-59-0 [RN]
Methanone, [3-(1-azetidinylmethyl)phenyl](4-bromophenyl)- [ACD/Index Name]
[3-(azetidin-1-ylmethyl)phenyl]-(4-bromophenyl)methanone
{3-[(Azetidin-1-yl)methyl]phenyl}(4-bromophenyl)methanone
1-{[3-(4-BROMOBENZOYL)PHENYL]METHYL}AZETIDINE
3-AZETIDIN-1-YLMETHYL-4'-BROMOBENZOPHENONE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 430.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 214.2±24.6 °C
Index of Refraction: 1.635
Molar Refractivity: 84.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 2.23
ACD/KOC (pH 5.5): 12.17
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 112.97
ACD/KOC (pH 7.4): 615.87
Polar Surface Area: 20 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 234.6±3.0 cm3

Click to predict properties on the Chemicalize site


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