Found 538 results

Search term: MF = 'C_{20}H_{30}N_{4}O_{6}'
ChemSpider 2D Image | 2-Methyl-2-propanyl (3S,4S)-3-hydroxy-4-{[4-(isopropylcarbamoyl)-2-nitrophenyl](methyl)amino}-1-pyrrolidinecarboxylate | C20H30N4O6

2-Methyl-2-propanyl (3S,4S)-3-hydroxy-4-{[4-(isopropylcarbamoyl)-2-nitrophenyl](methyl)amino}-1-pyrrolidinecarboxylate

  • Molecular FormulaC20H30N4O6
  • Average mass422.475 Da
  • Monoisotopic mass422.216522 Da
  • ChemSpider ID65045031

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-3-Hydroxy-4-{[4-(isopropylcarbamoyl)-2-nitrophényl](méthyl)amino}-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarboxylic acid, 3-hydroxy-4-[methyl[4-[[(1-methylethyl)amino]carbonyl]-2-nitrophenyl]amino]-, 1,1-dimethylethyl ester, (3S,4S)- [ACD/Index Name]
2-Methyl-2-propanyl (3S,4S)-3-hydroxy-4-{[4-(isopropylcarbamoyl)-2-nitrophenyl](methyl)amino}-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3S,4S)-3-hydroxy-4-{[4-(isopropylcarbamoyl)-2-nitrophenyl](methyl)amino}-1-pyrrolidincarboxylat [German] [ACD/IUPAC 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: 583.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 306.6±30.1 °C
Index of Refraction: 1.586
Molar Refractivity: 111.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.62
ACD/KOC (pH 5.5): 248.92
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.62
ACD/KOC (pH 7.4): 248.92
Polar Surface Area: 128 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 55.6±3.0 dyne/cm
Molar Volume: 333.0±3.0 cm3

Click to predict properties on the Chemicalize site


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