ChemSpider 2D Image | (2-Butyl-1-benzofuran-3-yl){4-[3-(dimethylamino)propoxy]-3,5-diiodophenyl}methanone | C24H27I2NO3

(2-Butyl-1-benzofuran-3-yl){4-[3-(dimethylamino)propoxy]-3,5-diiodophenyl}methanone

  • Molecular FormulaC24H27I2NO3
  • Average mass631.285 Da
  • Monoisotopic mass631.007996 Da
  • ChemSpider ID166788

More details:

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

(2-Butyl-1-benzofuran-3-yl){4-[3-(dimethylamino)propoxy]-3,5-diiodophenyl}methanone [ACD/IUPAC Name]
(2-Butyl-1-benzofuran-3-yl){4-[3-(diméthylamino)propoxy]-3,5-diiodophényl}méthanone [French] [ACD/IUPAC Name]
(2-Butyl-1-benzofuran-3-yl){4-[3-(dimethylamino)propoxy]-3,5-diiodphenyl}methanon [German] [ACD/IUPAC Name]
Methanone, (2-butyl-3-benzofuranyl)(4-(3-(dimethylamino)propoxy)-3,5-diiodophenyl)-
Methanone, (2-butyl-3-benzofuranyl)[4-[3-(dimethylamino)propoxy]-3,5-diiodophenyl]- [ACD/Index Name]
(2-Butylbenzofuran-3-yl)(4-(3-(dimethylamino)propoxy)-3,5-diiodophenyl)methanone
(2-butyl-benzofuran-3-yl)-4-[3-(dimethylaminopropoxy)-3,5-diiodophenyl]-methanone
5,5'-[methanediylbis(naphthalene-2,1-diyloxysulfonyl)]bis(2-diazonionaphthalen-1-olate)
77828-26-3 [RN]

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

L 6727 [DBID]
L-6727 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 626.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.5±31.5 °C
Index of Refraction: 1.632
Molar Refractivity: 139.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 121.94
ACD/KOC (pH 5.5): 151.15
ACD/LogD (pH 7.4): 5.19
ACD/BCF (pH 7.4): 1887.38
ACD/KOC (pH 7.4): 2339.52
Polar Surface Area: 43 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 391.7±3.0 cm3

Click to predict properties on the Chemicalize site


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