ChemSpider 2D Image | (DHQD)_2_PHAL | C48H54N6O4

(DHQD)2PHAL

  • Molecular FormulaC48H54N6O4
  • Average mass778.980 Da
  • Monoisotopic mass778.420654 Da
  • ChemSpider ID9392257

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

Featured data source
The Merck Index Online

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

(DHQD)2PHAL
(9S,9'''S)-9,9'-[1,4-Phtalazinediylbis(oxy)]bis(6'-méthoxy-10,11-dihydrocinchonan) [French] [ACD/IUPAC Name]
(9S,9'''S)-9,9'-[1,4-Phthalazindiylbis(oxy)]bis(6'-methoxy-10,11-dihydrocinchonan) [German] [ACD/IUPAC Name]
(9S,9'''S)-9,9'-[1,4-Phthalazinediylbis(oxy)]bis(6'-methoxy-10,11-dihydrocinchonan) [ACD/IUPAC Name]
(9S,9'''S)-9,9'-[Phthalazine-1,4-diylbis(oxy)]bis(6'-methoxy-10,11-dihydrocinchonan)
(DHQD)2PHAL
(DHQD)PHAL
1,4-Bis(dihydroquinidine)phthalazine
140853-10-7 [RN]
AD-mix-β
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5475678 [DBID]
392731_ALDRICH [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.688
Molar Refractivity: 228.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 9.20
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 76.12
ACD/KOC (pH 5.5): 51.84
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 297.14
ACD/KOC (pH 7.4): 202.37
Polar Surface Area: 95 Å2
Polarizability: 90.5±0.5 10-24cm3
Surface Tension: 68.9±5.0 dyne/cm
Molar Volume: 598.5±5.0 cm3

Click to predict properties on the Chemicalize site


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