ChemSpider 2D Image | PROXIMICIN B | C20H19N3O7

PROXIMICIN B

  • Molecular FormulaC20H19N3O7
  • Average mass413.381 Da
  • Monoisotopic mass413.122314 Da
  • ChemSpider ID24626549

More details:






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

{5-[(5-{[2-(4-Hydroxyphényl)éthyl]carbamoyl}-3-furyl)carbamoyl]-3-furyl}carbamate de méthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[5-[[[5-[[[2-(4-hydroxyphenyl)ethyl]amino]carbonyl]-3-furanyl]amino]carbonyl]-3-furanyl]-, methyl ester [ACD/Index Name]
Methyl {5-[(5-{[2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-furyl)carbamoyl]-3-furyl}carbamate [ACD/IUPAC Name]
Methyl-{5-[(5-{[2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-furyl)carbamoyl]-3-furyl}carbamat [German] [ACD/IUPAC Name]
PROXIMICIN B
1029061-05-9 [RN]
methyl N-{5-[(5-{[2-(4-hydroxyphenyl)ethyl]carbamoyl}furan-3-yl)carbamoyl]furan-3-yl}carbamate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 562.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 293.8±30.1 °C
Index of Refraction: 1.654
Molar Refractivity: 106.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.30
ACD/KOC (pH 5.5): 209.72
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.27
ACD/KOC (pH 7.4): 209.21
Polar Surface Area: 143 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 64.0±3.0 dyne/cm
Molar Volume: 289.3±3.0 cm3

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