ChemSpider 2D Image | (2R)-1-[(5-Chloro-3-nitro-2-pyridinyl)amino]-3-methoxy-2-propanol | C9H12ClN3O4

(2R)-1-[(5-Chloro-3-nitro-2-pyridinyl)amino]-3-methoxy-2-propanol

  • Molecular FormulaC9H12ClN3O4
  • Average mass261.662 Da
  • Monoisotopic mass261.051636 Da
  • ChemSpider ID60536666

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-[(5-Chlor-3-nitro-2-pyridinyl)amino]-3-methoxy-2-propanol [German] [ACD/IUPAC Name]
(2R)-1-[(5-Chloro-3-nitro-2-pyridinyl)amino]-3-methoxy-2-propanol [ACD/IUPAC Name]
(2R)-1-[(5-Chloro-3-nitro-2-pyridinyl)amino]-3-méthoxy-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[(5-chloro-3-nitro-2-pyridinyl)amino]-3-methoxy-, (2R)- [ACD/Index Name]
(2R)-1-[(5-CHLORO-3-NITROPYRIDIN-2-YL)AMINO]-3-METHOXYPROPAN-2-OL

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

Density: 1.5±0.1 g/cm3
Boiling Point: 469.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 237.9±28.7 °C
Index of Refraction: 1.613
Molar Refractivity: 62.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.35
ACD/KOC (pH 5.5): 321.67
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 22.35
ACD/KOC (pH 7.4): 321.68
Polar Surface Area: 100 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 179.7±3.0 cm3

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