ChemSpider 2D Image | (3R,4R)-1-Acetoxy-3-amino-4-methyl-2-pyrrolidinone | C7H12N2O3

(3R,4R)-1-Acetoxy-3-amino-4-methyl-2-pyrrolidinone

  • Molecular FormulaC7H12N2O3
  • Average mass172.182 Da
  • Monoisotopic mass172.084793 Da
  • ChemSpider ID32702445

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-1-Acetoxy-3-amino-4-methyl-2-pyrrolidinon [German] [ACD/IUPAC Name]
(3R,4R)-1-Acetoxy-3-amino-4-methyl-2-pyrrolidinone [ACD/IUPAC Name]
(3R,4R)-1-Acétoxy-3-amino-4-méthyl-2-pyrrolidinone [French] [ACD/IUPAC Name]
(3R,4R)-3-amino-4-methyl-2-oxopyrrolidin-1-yl acetate
1072933-71-1 [RN]
2-Pyrrolidinone, 1-(acetyloxy)-3-amino-4-methyl-, (3R,4R)- [ACD/Index Name]
(3R,4R)-3-Amino-1-hydroxy-4-methyl-2-pyrrolidinone Acetate
130931-66-7 [RN]
1983896-25-8 [RN]
cis-3-Amino-1-hydroxy-4-methyl-2-pyrrolidinone Acetate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 250.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.8±3.0 kJ/mol
Flash Point: 105.5±30.1 °C
Index of Refraction: 1.518
Molar Refractivity: 41.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.72
ACD/LogD (pH 5.5): -3.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.52
Polar Surface Area: 73 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 48.0±5.0 dyne/cm
Molar Volume: 138.1±5.0 cm3

Click to predict properties on the Chemicalize site


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