Found 49 results

Search term: MF = 'C_{13}H_{13}Br_{2}NO_{5}'
ChemSpider 2D Image | {5-[(4,6-Dibromo-7-methoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanol | C13H13Br2NO5

{5-[(4,6-Dibromo-7-methoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanol

  • Molecular FormulaC13H13Br2NO5
  • Average mass423.054 Da
  • Monoisotopic mass420.916046 Da
  • ChemSpider ID22751698

More details:

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

{5-[(4,6-Dibrom-7-methoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanol [German] [ACD/IUPAC Name]
{5-[(4,6-Dibromo-7-methoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanol [ACD/IUPAC Name]
{5-[(4,6-Dibromo-7-méthoxy-1,3-benzodioxol-5-yl)méthyl]-4,5-dihydro-1,2-oxazol-3-yl}méthanol [French] [ACD/IUPAC Name]
3-Isoxazolemethanol, 5-[(4,6-dibromo-7-methoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro- [ACD/Index Name]
[5-(4,6-Dibromo-7-methoxy-benzo[1,3]dioxol-5-ylmethyl)-4,5-dihydro-isoxazol-3-yl]-methanol
{5-[(4,6-dibromo-7-methoxy-2H-benzo[3,4-d]1,3-dioxolen-5-yl)methyl]-4,5-dihydroisoxazol-3-yl}methan-1-ol

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

Density: 2.0±0.1 g/cm3
Boiling Point: 484.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 246.8±31.5 °C
Index of Refraction: 1.684
Molar Refractivity: 79.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 254.67
ACD/KOC (pH 5.5): 1835.70
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 254.67
ACD/KOC (pH 7.4): 1835.69
Polar Surface Area: 70 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 57.1±7.0 dyne/cm
Molar Volume: 208.6±7.0 cm3

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