ChemSpider 2D Image | 2,3-Dihydroxy-3-[(7Z)-3,4,5,8,11,17,18,19,22,23,34-undecahydroxy-14,26,31,35-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.0~2,7~.0~15,20~.0~21,30~.0~24,29~.0~28,33~]pentatriaconta-1,3,5,7,15,17,19,21 ,23,29,33-undecaen-10-yl]propanal | C34H24O22

2,3-Dihydroxy-3-[(7Z)-3,4,5,8,11,17,18,19,22,23,34-undecahydroxy-14,26,31,35-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1,3,5,7,15,17,19,21 ,23,29,33-undecaen-10-yl]propanal

  • Molecular FormulaC34H24O22
  • Average mass784.541 Da
  • Monoisotopic mass784.075928 Da
  • ChemSpider ID4579439

  • Double-bond stereo - Double-bond stereo

More details:

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

2,3-Dihydroxy-3-[(7Z)-3,4,5,8,11,17,18,19,22,23,34-undecahydroxy-14,26,31,35-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1,3,5,7,15,17,19,21
 ,23,29,33-undecaen-10-yl]propanal [ACD/IUPAC Name]
2,3-Dihydroxy-3-[(7Z)-3,4,5,8,11,17,18,19,22,23,34-undecahydroxy-14,26,31,35-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1,3,5,7,15,17,19,21
 ,23,29,33-undecaen-10-yl]propanal [German] [ACD/IUPAC Name]
2,3-Dihydroxy-3-[(7Z)-3,4,5,8,11,17,18,19,22,23,34-undécahydroxy-14,26,31,35-tétraoxo-9,13,25,32-tétraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1,3,5,7,15,17,19,21
 ,23,29,33-undécaén-10-yl]propanal [French] [ACD/IUPAC Name]

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

NSC676824 [DBID]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 1080.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 166.0±3.0 kJ/mol
Flash Point: 343.0±27.8 °C
Index of Refraction: 1.946
Molar Refractivity: 168.2±0.4 cm3
#H bond acceptors: 22
#H bond donors: 13
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: -1.10
ACD/LogD (pH 5.5): -3.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 385 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 204.2±5.0 dyne/cm
Molar Volume: 349.2±5.0 cm3

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