ChemSpider 2D Image | 2,2,7,7,12,12,17,17-Octamethyl-24-phenyl-26-oxa-25,27-diaza-24-phosphahexacyclo[16.5.1.1~3,6~.1~8,11~.1~13,16~.0~19,23~]heptacosa-1(23),3,5,8,10,13,15,18-octaene 24-sulfide | C37H43N2OPS

2,2,7,7,12,12,17,17-Octamethyl-24-phenyl-26-oxa-25,27-diaza-24-phosphahexacyclo[16.5.1.13,6.18,11.113,16.019,23]heptacosa-1(23),3,5,8,10,13,15,18-octaene 24-sulfide

  • Molecular FormulaC37H43N2OPS
  • Average mass594.789 Da
  • Monoisotopic mass594.283386 Da
  • ChemSpider ID21152102

More details:

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

2,2,7,7,12,12,17,17-Octamethyl-24-phenyl-26-oxa-25,27-diaza-24-phosphahexacyclo[16.5.1.13,6.18,11.113,16.019,23]heptacosa-1(23),3,5,8,10,13,15,18-octaen-24-sulfid [German] [ACD/IUPAC Name]
2,2,7,7,12,12,17,17-Octamethyl-24-phenyl-26-oxa-25,27-diaza-24-phosphahexacyclo[16.5.1.13,6.18,11.113,16.019,23]heptacosa-1(23),3,5,8,10,13,15,18-octaene 24-sulfide [ACD/IUPAC Name]
24-Sulfure de 2,2,7,7,12,12,17,17-octaméthyl-24-phényl-26-oxa-25,27-diaza-24-phosphahexacyclo[16.5.1.13,6.18,11.113,16.019,23]heptacosa-1(23),3,5,8,10,13,15,18-octaène [French] [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: 702.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 378.9±35.7 °C
Index of Refraction: 1.650
Molar Refractivity: 175.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 87 Å2
Polarizability: 69.7±0.5 10-24cm3
Surface Tension: 57.9±5.0 dyne/cm
Molar Volume: 481.6±5.0 cm3

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