ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-yl)succinic acid | C11H10O6

2-(1,3-Benzodioxol-5-yl)succinic acid

  • Molecular FormulaC11H10O6
  • Average mass238.193 Da
  • Monoisotopic mass238.047745 Da
  • ChemSpider ID25811657

More details:






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

2-(1,3-Benzodioxol-5-yl)bernsteinsäure [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)succinic acid [ACD/IUPAC Name]
Acide 2-(1,3-benzodioxol-5-yl)succinique [French] [ACD/IUPAC Name]
Butanedioic acid, 2-(1,3-benzodioxol-5-yl)- [ACD/Index Name]
2-(1,3-BENZODIOXOL-5-YL)-BUTANEDIOIC ACID
2-(1,3-dioxaindan-5-yl)butanedioic acid
2-(2H-1,3-benzodioxol-5-yl)butanedioic acid
2-(benzo[d][1,3]dioxol-5-yl)succinic acid
861515-76-6 [RN]
MFCD01050399
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 378.5±42.0 °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: 148.8±21.4 °C
Index of Refraction: 1.612
Molar Refractivity: 54.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 75.4±3.0 dyne/cm
Molar Volume: 156.4±3.0 cm3

Click to predict properties on the Chemicalize site






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