ChemSpider 2D Image | 2-Amino(3,3,4,4,5,5-~2~H_6_)heptanedioic acid | C7H7D6NO4

2-Amino(3,3,4,4,5,5-2H6)heptanedioic acid

  • Molecular FormulaC7H7D6NO4
  • Average mass181.219 Da
  • Monoisotopic mass181.122116 Da
  • ChemSpider ID128918239

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Amino(3,3,4,4,5,5-2H6)heptandisäure [German] [ACD/IUPAC Name]
2-Amino(3,3,4,4,5,5-2H6)heptanedioic acid [ACD/IUPAC Name]
Acide 2-amino(3,3,4,4,5,5-2H6)heptanedioïque [French] [ACD/IUPAC Name]
Heptanedioic-3,3,4,4,5,5-d6 acid, 2-amino- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 378.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 68.8±6.0 kJ/mol
Flash Point: 182.7±26.5 °C
Index of Refraction: 1.510
Molar Refractivity: 41.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -3.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 137.4±3.0 cm3

Click to predict properties on the Chemicalize site


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