ChemSpider 2D Image | MFCD00084172 | C8H2D4O4

MFCD00084172

  • Molecular FormulaC8H2D4O4
  • Average mass170.156 Da
  • Monoisotopic mass170.051712 Da
  • ChemSpider ID17339921
  • Non-standard isotope - Non-standard isotope


More details:






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

(2H4)Benzene-1,2-dicarboxylic acid
1,2-(2H4)Benzenedicarboxylic acid [ACD/IUPAC Name]
1,2-(2H4)Benzoldicarbonsäure [German] [ACD/IUPAC Name]
1,2-Benzene-d4-dicarboxylic acid [ACD/Index Name]
87976-26-9 [RN]
Acide 1,2-(2H4)benzènedicarboxylique [French] [ACD/IUPAC Name]
MFCD00084172
Phthalic acid-phenyl-d4
Phthalic-3,4,5,6-d4 Acid
3,4,5,6-tetradeuteriophthalic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

318027_ALDRICH [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 378.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 196.7±19.7 °C
Index of Refraction: 1.618
Molar Refractivity: 40.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 70.3±3.0 dyne/cm
Molar Volume: 114.5±3.0 cm3

Click to predict properties on the Chemicalize site






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