ChemSpider 2D Image | (2R,4R)-4-Amino-1-methyl-2,4-pyrrolidinedicarboxylic acid | C7H12N2O4

(2R,4R)-4-Amino-1-methyl-2,4-pyrrolidinedicarboxylic acid

  • Molecular FormulaC7H12N2O4
  • Average mass188.181 Da
  • Monoisotopic mass188.079712 Da
  • ChemSpider ID23153477
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2R,4R)-4-Amino-1-methyl-2,4-pyrrolidindicarbonsäure [German] [ACD/IUPAC Name]
(2R,4R)-4-Amino-1-methyl-2,4-pyrrolidinedicarboxylic acid [ACD/IUPAC Name]
(2R,4R)-4-amino-1-methylpyrrolidine-2,4-dicarboxylic acid
2,4-Pyrrolidinedicarboxylic acid, 4-amino-1-methyl-, (2R,4R)- [ACD/Index Name]
Acide (2R,4R)-4-amino-1-méthyl-2,4-pyrrolidinedicarboxylique [French] [ACD/IUPAC Name]
(2R,4R)-4-Amino-1-methyl-pyrrolidine-2,4-dicarboxylic acid
2,4-Pyrrolidinedicarboxylic acid, 4-amino-1-methyl-, (2R,4R)- (9CI)
2,4-pyrrolidinedicarboxylic acid,4-amino-1-methyl-,(2r,4r)-
213619-98-8 [RN]
CHEMBL300330

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 354.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 65.9±6.0 kJ/mol
Flash Point: 168.4±27.9 °C
Index of Refraction: 1.564
Molar Refractivity: 42.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.91
ACD/LogD (pH 5.5): -3.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 130.3±3.0 cm3

Click to predict properties on the Chemicalize site






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