ChemSpider 2D Image | 2-[(3-Bromo-5-nitro-2-pyridinyl)amino]-2-methyl-1,3-propanediol | C9H12BrN3O4

2-[(3-Bromo-5-nitro-2-pyridinyl)amino]-2-methyl-1,3-propanediol

  • Molecular FormulaC9H12BrN3O4
  • Average mass306.113 Da
  • Monoisotopic mass305.001099 Da
  • ChemSpider ID30297670

More details:

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

1,3-Propanediol, 2-[(3-bromo-5-nitro-2-pyridinyl)amino]-2-methyl- [ACD/Index Name]
2-[(3-Brom-5-nitro-2-pyridinyl)amino]-2-methyl-1,3-propandiol [German] [ACD/IUPAC Name]
2-[(3-Bromo-5-nitro-2-pyridinyl)amino]-2-methyl-1,3-propanediol [ACD/IUPAC Name]
2-[(3-Bromo-5-nitro-2-pyridinyl)amino]-2-méthyl-1,3-propanediol [French] [ACD/IUPAC Name]
1445149-21-2 [RN]
MFCD25579903

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

Density: 1.8±0.1 g/cm3
Boiling Point: 518.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 267.1±30.1 °C
Index of Refraction: 1.668
Molar Refractivity: 65.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.44
ACD/KOC (pH 5.5): 146.32
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.44
ACD/KOC (pH 7.4): 146.32
Polar Surface Area: 111 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 75.0±3.0 dyne/cm
Molar Volume: 174.7±3.0 cm3

Click to predict properties on the Chemicalize site


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