ChemSpider 2D Image | 2-Methyl-2-propanyl {2-[40,41-dihydroxy-5,13-dioxo-3,15-dioxa-6,9,12-triazahexacyclo[15.15.7.1~23,27~.1~34,38~.0~2,29~.0~16,21~]hentetraconta-1,16,18,20,23(41),24,26,29,31,34(40),35,37-dodecaen-9-yl]e thyl}carbamate | C43H50N4O8

2-Methyl-2-propanyl {2-[40,41-dihydroxy-5,13-dioxo-3,15-dioxa-6,9,12-triazahexacyclo[15.15.7.123,27.134,38.02,29.016,21]hentetraconta-1,16,18,20,23(41),24,26,29,31,34(40),35,37-dodecaen-9-yl]e thyl}carbamate

  • Molecular FormulaC43H50N4O8
  • Average mass750.879 Da
  • Monoisotopic mass750.362854 Da
  • ChemSpider ID8994158

More details:

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

{2-[40,41-Dihydroxy-5,13-dioxo-3,15-dioxa-6,9,12-triazahexacyclo[15.15.7.123,27.134,38.02,29.016,21]héntétraconta-1,16,18,20,23(41),24,26,29,31,34(40),35,37-dodécaén-9-yl]éthyl}carbamate de 2-
 méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {2-[40,41-dihydroxy-5,13-dioxo-3,15-dioxa-6,9,12-triazahexacyclo[15.15.7.123,27.134,38.02,29.016,21]hentetraconta-1,16,18,20,23(41),24,26,29,31,34(40),35,37-dodecaen-9-yl]e
 thyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{2-[40,41-dihydroxy-5,13-dioxo-3,15-dioxa-6,9,12-triazahexacyclo[15.15.7.123,27.134,38.02,29.016,21]hentetraconta-1,16,18,20,23(41),24,26,29,31,34(40),35,37-dodecaen-9-yl]e
 thyl}carbamat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 954.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 143.8±3.0 kJ/mol
Flash Point: 531.2±34.3 °C
Index of Refraction: 1.577
Molar Refractivity: 207.4±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 2.81
ACD/KOC (pH 5.5): 12.89
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 129.97
ACD/KOC (pH 7.4): 595.82
Polar Surface Area: 159 Å2
Polarizability: 82.2±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 626.1±3.0 cm3

Click to predict properties on the Chemicalize site


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