ChemSpider 2D Image | 5-[3,5-bis(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid | C30H18O12

5-[3,5-bis(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid

  • Molecular FormulaC30H18O12
  • Average mass570.457 Da
  • Monoisotopic mass570.079834 Da
  • ChemSpider ID26510557

More details:






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

1228047-98-0 [RN]
1228047-99-1 [RN]
3,3',3'',5,5',5''-benzene-1,3,5-triylhexabenzoic acid
3,3',3'',5,5',5''-benzene-1,3,5-triyl-hexabenzoic acid
5'-(3,5-Dicarboxyphenyl)-[1,1':3',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid
MFCD30541554
PUBCHEM_57149583

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1026.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 157.2±3.0 kJ/mol
Flash Point: 588.5±30.8 °C
Index of Refraction: 1.715
Molar Refractivity: 141.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 4
ACD/LogP: 7.78
ACD/LogD (pH 5.5): -0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 224 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 86.8±3.0 dyne/cm
Molar Volume: 360.5±3.0 cm3

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