Found 1 result

Search term: MF = 'C_{10}H_{5}D_{9}N_{2}O_{4}'
ChemSpider 2D Image | 3-{5-[Amino(~2~H_2_)methyl]-4-[carboxy(~2~H_2_)methyl](2-~2~H)-1H-pyrrol-3-yl}(~2~H_4_)propanoic acid | C10H5D9N2O4

3-{5-[Amino(2H2)methyl]-4-[carboxy(2H2)methyl](2-2H)-1H-pyrrol-3-yl}(2H4)propanoic acid

  • Molecular FormulaC10H5D9N2O4
  • Average mass235.285 Da
  • Monoisotopic mass235.151855 Da
  • ChemSpider ID8374079

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrrole-2-d-3-propanoic-d4 acid, 5-(aminomethyl-d2)-4-(carboxymethyl-d2)- [ACD/Index Name]
3-{5-[Amino(2H2)methyl]-4-[carboxy(2H2)methyl](2-2H)-1H-pyrrol-3-yl}(2H4)propanoic acid [ACD/IUPAC Name]
3-{5-[Amino(2H2)methyl]-4-[carboxy(2H2)methyl](2-2H)-1H-pyrrol-3-yl}(2H4)propansäure [German] [ACD/IUPAC Name]
Acide 3-{5-[amino(2H2)méthyl]-4-[carboxy(2H2)méthyl](2-2H)-1H-pyrrol-3-yl}(2H4)propanoïque [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 478.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 243.2±27.3 °C
Index of Refraction: 1.621
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.30
ACD/LogD (pH 5.5): -3.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 116 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 75.6±3.0 dyne/cm
Molar Volume: 159.1±3.0 cm3

Click to predict properties on the Chemicalize site


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